Crystallography Open Database
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Searching journal of publication like 'Journal of Organic Chemistry'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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4023026 | CIF | C H Cl N O | P 1 21/c 1 | 7.3223; 16.257; 15.537 90; 101.432; 90 | 1812.8 | Tao Xiong; Qian Zhang; Zhiguo Zhang; Qun Liu A Divergent Synthesis of γ-Iminolactones, Dihydroquinolin-2-ones, and γ-Lactames from β-Hydroxymethylcyclopropanylamides Journal of Organic Chemistry, 2007, 72, 8005-8009 |
4027424 | CIF | C H Cl N O | P n a 21 | 13.8598; 11.5756; 23.3102 90; 90; 90 | 3739.8 | Zhiguo Zhang; Shiliang Fang; Qingfeng Liu; Guisheng Zhang Approach to Polysubstituted 4-Pyridones from N-Aryl Acetoacetamides via a N to C1,3-Acyl Migration Mediated by Sodium Persulfate Journal of Organic Chemistry, 2012, 77, 7665-7670 |
4025304 | CIF | C H I | C 1 2/c 1 | 30.2468; 18.3785; 17.2888 90; 96.041; 90 | 9557.3 | Frances A. Murphy; Sylvia M. Draper Superaromatic Terpyridines: Hexa-peri-hexabenzocoronenes with Tridentate Functionality Journal of Organic Chemistry, 2010, 75, 1862-1870 |
4020372 | CIF | C H N S | P 21 21 21 | 6.928; 9.9129; 12.5725 90; 90; 90 | 863.44 | Li Gao; Rawle I. Hollingsworth Design and Evaluation of Dihydroxytetrahydro-1H-pyrrolo[2,1-c]-[1,4]benzothiazines as Conformationally Restricted Transition-State Inhibitors of β-Ribosidases Journal of Organic Chemistry, 2005, 70, 9013-9016 |
4027917 | CIF | C H O | P -3 | 12.0399; 12.0399; 9.8716 90; 90; 120 | 1239.26 | Tao Wang; Yu-Fei Zhang; Qin-Qing Hou; Wen-Rong Xu; Xiao-Ping Cao; Hak-Fun Chow; Dietmar Kuck C3-Symmetrical Tribenzotriquinacene Derivatives: Optical Resolution through Cryptophane Synthesis and Supramolecular Self-Assembly into Nanotubes Journal of Organic Chemistry, 2013, 78, 1062-1069 |
4038501 | CIF | C1.714 H1.486 N0.343 | P 1 21/n 1 | 7.022; 11.2016; 15.789 90; 99.001; 90 | 1226.6 | Kumar, Neha; Agrawal, Abhijeet R.; Choudhury, Aditya; Zade, Sanjio S. The Effect of Base and Nucleophile on the Nucleophilic Substitution of Methoxytropone Derivatives: An Easy Access to 4- and 5-Substituted Multifunctional Azulenes. The Journal of organic chemistry, 2020 |
4020280 | CIF | C10 H10 Ag N O3 Se5 | P 1 21/n 1 | 10.725; 11.207; 12.938 90; 93.565; 90 | 1552.1 | Toshio Shimizu; Mari Kawaguchi; Takahiro Tsuchiya; Kazunori Hirabayashi; Nobumasa Kamigata Journal of Organic Chemistry, 2005, 70, 5036-5044 |
4033735 | CIF | C10 H10 B0.25 Cl0.25 F0.25 N2 O3 | P -1 | 10.1007; 11.0329; 12.8754 114.896; 108.439; 94.763 | 1195.08 | Belmonte-Vázquez, José L; Avellanal-Zaballa, Edurne; Enríquez-Palacios, Ernesto; Cerdán, Luis; Esnal, Ixone; Bañuelos, Jorge; Villegas-Gómez, Clarisa; López Arbeloa, Iñigo; Peña-Cabrera, Eduardo Synthetic Approach to Readily Accessible Benzofuran-Fused Borondipyrromethenes as Red-Emitting Laser Dyes. The Journal of organic chemistry, 2019, 84, 2523-2541 |
4020656 | CIF | C10 H10 Br2 N2 O3 | P 21 21 21 | 5.497; 9.9352; 23.478 90; 90; 90 | 1282.2 | Jignesh Patel; Nadia Pelloux-Léon; Frédéric Minassian; Yannick Vallée Syntheses of S-Enantiomers of Hanishin, Longamide B, and Longamide B Methyl Ester from L-Aspartic Acid β-Methyl Ester: Establishment of Absolute Stereochemistry Journal of Organic Chemistry, 2005, 70, 9081-9084 |
4020461 | CIF | C10 H10 Br2 N2 O5 | C 1 2/c 1 | 38.2555; 4.6699; 14.6279 90; 94.597; 90 | 2604.86 | J. Jonathan Harburn; Nigam P. Rath; Christopher D. Spilling Journal of Organic Chemistry, 2005, 70, 6398-6403 |
4026258 | CIF | C10 H10 Br2 O6 | C 1 c 1 | 16.458; 6.3995; 13.491 90; 115.273; 90 | 1284.9 | Faiz Ahmed Khan; Ch. Nageswara Rao Grob Fragmentation of Norbornyl α-Diketones: A Route to α-Ketoenols and Aromatic Compounds Journal of Organic Chemistry, 2011, 76, 3320-3328 |
4034969 | CIF | C10 H10 Cl N O2 S | P 1 21/c 1 | 10.2094; 14.5436; 7.83158 90; 109.471; 90 | 1096.34 | Samper Barceló, Víctor; Bienz, Stefan Synthesis of Highly Substituted 3-Pyrrolin-2-ones from N,N-Disubstituted α-Amino Acids. The Journal of organic chemistry, 2018, 83, 2734-2743 |
4032484 | CIF | C10 H10 Cl N5 O | P 1 21/c 1 | 6.147; 13.509; 13.966 90; 105.541; 90 | 1117.3 | Centore, Roberto; Manfredi, Carla; Capobianco, Amedeo; Volino, Sabato; Ferrara, Maria Vittoria; Carella, Antonio; Fusco, Sandra; Peluso, Andrea Solid State Separation and Isolation of Tautomers of Fused-Ring Triazolotriazoles. The Journal of organic chemistry, 2017 |
4028635 | CIF | C10 H10 Cl0 N2 O2 | P 21 21 21 | 7.4578; 9.7077; 50.505 90; 90; 90 | 3656.5 | Veerle Smout; Aldo Peschiulli; Stefan Verbeeck; Emily A. Mitchell; Wouter Herrebout; Patrick Bultinck; Christophe M. L. Vande Velde; Didier Berthelot; Lieven Meerpoel; Bert U. W. Maes Removal of the Pyridine Directing Group from α-Substituted N-(Pyridin-2-yl)piperidines Obtained via Directed Ru-Catalyzed sp3 C-H Functionalization Journal of Organic Chemistry, 2013, 78, 9803-9814 |
4022531 | CIF | C10 H10 Cl2 N2 S2 Zn | C 1 2/c 1 | 9.345; 11.447; 13.661 90; 109.105; 90 | 1380.9 | John Y. L. Chung; Raymond J. Cvetovich; Fuh-Rong Tsay; Peter G. Dormer; Lisa DiMichele; David J. Mathre; Jennifer R. Chilenski; Bing Mao; Robert Wenslow Synthesis of 3-Aminopyrazinone Mediated by 2-Pyridylthioimidate-ZnCl~2~ Complexes. Development of an Efficient Route to a Thrombin Inhibitor Journal of Organic Chemistry, 2003, 68, 8838-8846 |
4032502 | CIF | C10 H10 F N O4 | P 1 21/c 1 | 13.8582; 8.4793; 17.1636 90; 94.026; 90 | 2011.9 | Motornov, Vladimir A.; Muzalevskiy, Vasiliy M.; Tabolin, Andrey A.; Novikov, Roman A.; Nelyubina, Yulia V.; Nenajdenko, Valentine G.; Ioffe, Sema L. Radical Nitration-Debromination of α-Bromo-α-fluoroalkenes as a Stereoselective Route to Aromatic α-Fluoronitroalkenes-Functionalized Fluorinated Building Blocks for Organic Synthesis. The Journal of organic chemistry, 2017 |
4022632 | CIF | C10 H10 F2 N2 O4 | P 1 21 1 | 6.5347; 7.0844; 11.655 90; 96.388; 90 | 536.21 | Ireneusz Nowak; John F. Cannon; Morris J. Robins Addition of Difluorocarbene to 3',4'-Unsaturated Nucleosides: Synthesis of 2'-Deoxy Analogues with a 2-Oxabicyclo[3.1.0]hexane Framework Journal of Organic Chemistry, 2007, 72, 532-537 |
4022842 | CIF | C10 H10 F2 N2 O5 | P 1 21 1 | 6.9293; 7.5038; 10.7401 90; 93.891; 90 | 557.16 | Ireneusz Nowak; Morris J. Robins Synthesis of 3'-Deoxynucleosides with 2-Oxabicyclo[3.1.0]hexane Sugar Moieties: Addition of Difluorocarbene to a 3',4'-Unsaturated Uridine Derivative and 1,2-Dihydrofurans Derived from D- and L-Xylose Journal of Organic Chemistry, 2007, 72, 3319-3325 |
4021141 | CIF | C10 H10 F3 N O7 | P -1 | 5.139; 7.391; 16.684 98.61; 96.12; 94.06 | 620.55 | Matthias Pohlman; Uli Kazmaier; Thomas Lindner Allylic Alkylation versus Michael Induced Ring Closure: Chelated Enolates as Versatile Nucleophiles Journal of Organic Chemistry, 2004, 69, 6909-6912 |
4032035 | CIF | C10 H10 F5 N O5 S | P 1 21/c 1 | 14.587; 6.5046; 15.2015 90; 116.131; 90 | 1294.9 | Ponomarenko, Maksym V.; Grabowsky, Simon; Pal, Rumpa; Röschenthaler, Gerd-Volker; Fokin, Andrey A. SF5-Enolates in Ti(IV)-Mediated Aldol Reactions. The Journal of organic chemistry, 2016, 81, 6783-6791 |
4020789 | CIF | C10 H10 N10 O10 | P 21 21 21 | 7.1557; 7.5846; 36.427 90.005; 90.002; 89.94 | 1977 | Huaqing Liu; Francis A. Kerdesky; Lawrence A. Black; Michael Fitzgerald; Rodger Henry; Timothy A. Esbenshade; Arthur A. Hancock; Youssef L. Bennani An Efficient Multigram Synthesis of the Potent Histamine H~3~ Antagonist GT-2331 and the Reassessment of the Absolute Configuration Journal of Organic Chemistry, 2004, 69, 192-194 |
4031917 | CIF | C10 H10 N2 O | P 21 21 21 | 6.6165; 8.5077; 15.0826 90; 90; 90 | 849.02 | Zhang, Shi-Jin; Sun, Wen-Wu; Cao, Pei; Dong, Xiao-Ping; Liu, Ji-Kai; Wu, Bin Stereoselective Synthesis of Diazabicyclic β-Lactams through Intramolecular Amination of Unactivated C(sp(3))-H Bonds of Carboxamides by Palladium Catalysis. The Journal of organic chemistry, 2016, 81, 956-968 |
4033544 | CIF | C10 H10 N2 O | P 1 21/n 1 | 8.3909; 8.3286; 12.4602 90; 93.482; 90 | 869.17 | Derosa, Joseph; O'Duill, Miriam L; Holcomb, Matthew; Boulous, Mark N.; Patman, Ryan L.; Wang, Fen; Tran-Dubé, Michelle; McAlpine, Indrawan; Engle, Keary M. Copper-Catalyzed Chan-Lam Cyclopropylation of Phenols and Azaheterocycles. The Journal of organic chemistry, 2018, 83, 3417-3425 |
4034536 | CIF | C10 H10 N2 O | P 1 21/c 1 | 45.984; 14.1262; 15.9483 90; 92.21; 90 | 10352 | Bisht, Girish Singh; Gnanaprakasam, Boopathy Transition-Metal-Free Addition Reaction for the Synthesis of 3-(Aminobenzylidene/aminoalkylidene)indolin-2-ones and Its Synthetic Applications. The Journal of organic chemistry, 2019, 84, 13516-13527 |
4032507 | CIF | C10 H10 N2 O2 | P 1 21/n 1 | 5.793; 23.033; 7.148 90; 102.186; 90 | 932.3 | Yedage, Subhash Laxman; Bhanage, Bhalchandra M. tert-Butyl Nitrite Mediated Synthesis of N-nitrosoamides, Carboxylic Acids, Benzocoumarins and Isocoumarins from Amides. The Journal of organic chemistry, 2017 |
4035001 | CIF | C10 H10 N2 O2 | P c a 21 | 13.755; 5.1325; 25.638 90; 90; 90 | 1810 | Maity, Rajib; Naskar, Sandip; Das, Indrajit Copper(II)-Catalyzed Reactions of α-Keto Thioesters with Azides via C-C and C-S Bond Cleavages: Synthesis of N-Acylureas and Amides. The Journal of organic chemistry, 2018, 83, 2114-2124 |
4037855 | CIF | C10 H10 N2 O3 | P 1 21/c 1 | 9.6285; 11.3962; 9.9019 90; 115.8; 90 | 978.21 | Bracken, Cormac; Baumann, Marcus Development of a Continuous Flow Photoisomerization Reaction Converting Isoxazoles into Diverse Oxazole Products. The Journal of organic chemistry, 2020 |
4025614 | CIF | C10 H10 N2 O4 | P 1 21/n 1 | 10.626; 5.8228; 16.673 90; 104.11; 90 | 1000.5 | Marcus Angelin; Martin Rahm; Andreas Fischer; Tore Brinck; Olof Ramström Diastereoselective One-Pot Tandem Synthesis of 3-Substituted Isoindolinones: A Mechanistic Investigation Journal of Organic Chemistry, 2010, 75, 5882-5887 |
4029014 | CIF | C10 H10 N2 O4 | P -1 | 7.107; 7.758; 10.62 75.924; 79.636; 71.112 | 534.1 | Wang, Zheng-Lin; Li, Hong-Liang; Ge, Li-Shi; An, Xing-Lan; Zhang, Zi-Gang; Luo, Xiaoyan; Fossey, John S.; Deng, Wei-Ping DDQ-Mediated Oxidative Coupling: An Approach to 2,3-Dicyanofuran (Thiophene). The Journal of organic chemistry, 2014, 79, 1156 |
4026507 | CIF | C10 H10 N2 O6 S | P 21 21 21 | 7.6599; 9.3279; 16.515 90; 90; 90 | 1180 | Suneel P. Singh; Alex Michaelides; A. Rod Merrill; Adrian L. Schwan A Microwave-Assisted Synthesis of (S)-N-Protected Homoserine γ-Lactones from l-Aspartic Acid Journal of Organic Chemistry, 2011, 76, 6825-6831 |
4026096 | CIF | C10 H10 N2 P2 S5 | P -1 | 9.382; 12.916; 13.29 89.09; 88.04; 86.02 | 1605.5 | Jan Bergman; Birgitta Pettersson; Vedran Hasimbegovic; Per H. Svensson Thionations Using a P4S10-Pyridine Complex in Solvents Such as Acetonitrile and Dimethyl Sulfone Journal of Organic Chemistry, 2011, 76, 1546-1553 |
4030565 | CIF | C10 H10 N2 S2 | P 1 21/c 1 | 9.656; 8.9641; 11.7189 90; 96.272; 90 | 1008.29 | Aruri, Hariprasad; Singh, Umed; Sharma, Sumit; Gudup, Satish; Bhogal, Mukesh; Kumar, Sanjay; Singh, Deepika; Gupta, Vivek K.; Kant, Rajni; Vishwakarma, Ram A.; Singh, Parvinder Pal Cross-Dehydrogenative Coupling of Azoles with α-C(sp(3))-H of Ethers and Thioethers under Metal-Free Conditions: Functionalization of H-N Azoles via C-H Activation. The Journal of organic chemistry, 2015, 80, 1929-1936 |
4022530 | CIF | C10 H10 N4 O | C 1 c 1 | 4.47; 23.896; 9.34 90; 99.376; 90 | 984.3 | Marcus H. Holschbach; Dionisia Sanz; Rosa M. Claramunt; Lourdes Infantes; Sam Motherwell; Paul R. Raithby; María Luisa Jimeno; David Herrero; Ibon Alkorta; Nadine Jagerovic; José Elguero Structure of a 4-Nitroso-5-aminopyrazole and Its Salts: Tautomerism, Protonation, and E/Z Isomerism Journal of Organic Chemistry, 2003, 68, 8831-8837 |
4025682 | CIF | C10 H10 O S3 | P 1 21/n 1 | 13.169; 6.129; 13.994 90; 108.241; 90 | 1072.7 | William Clegg; Ross W. Harrington; Michael North; Pedro Villuendas A Bimetallic Aluminum(salen) Complex for the Synthesis of 1,3-Oxathiolane-2-thiones and 1,3-Dithiolane-2-thiones Journal of Organic Chemistry, 2010, 75, 6201-6207 |
4023154 | CIF | C10 H10 O S5 | P 1 21/c 1 | 7.196; 18.705; 10.344 90; 108.95; 90 | 1316.9 | Takahiro Tsuchiya; Yosuke Okada; Toshio Shimizu; Kazunori Hirabayashi; Nobumasa Kamigata Molecular Transformations of Unsaturated Thiacrown Ethers Journal of Organic Chemistry, 2008, 73, 76-80 |
4028822 | CIF HKL | C10 H10 O3 | P 1 21/n 1 | 8.2592; 5.45466; 38.5981 90; 91.672; 90 | 1738.15 | Joanna V. Geden; Benjamin O. Beasley; Guy J. Clarkson; Michael Shipman Asymmetric Synthesis of 2-Substituted Oxetan-3-ones via Metalated SAMP/RAMP Hydrazones Journal of Organic Chemistry, 2013, 78, 12243-12250 |
4028823 | CIF HKL | C10 H10 O3 | P 1 21/n 1 | 5.91473; 17.3076; 8.6214 90; 100.809; 90 | 866.91 | Joanna V. Geden; Benjamin O. Beasley; Guy J. Clarkson; Michael Shipman Asymmetric Synthesis of 2-Substituted Oxetan-3-ones via Metalated SAMP/RAMP Hydrazones Journal of Organic Chemistry, 2013, 78, 12243-12250 |
4037897 | CIF | C10 H10 O4 | P -1 | 7.6463; 11.753; 12.203 117.17; 100.016; 90.347 | 956.2 | Kumar, Anil; Prabhu, Kandikere Ramaiah Rhodium(III)-Catalyzed C-H Activation: A Cascade Approach for the Regioselective Synthesis of Fused Heterocyclic Lactone Scaffolds. The Journal of organic chemistry, 2020 |
4022088 | CIF | C10 H11 F2 N3 O3 | P 1 21 1 | 5.3533; 17.484; 12.0785 90; 100.109; 90 | 1113 | Ireneusz Nowak; Morris J. Robins Addition of Difluorocarbene to 4',5'-Unsaturated Nucleosides: Synthesis and Deoxygenation Reactions of Difluorospirocyclopropane Nucleosides Journal of Organic Chemistry, 2006, 71, 8876-8883 |
4022843 | CIF | C10 H11 F2 N3 O4 | P 21 21 21 | 6.2374; 9.8577; 18.1082 90; 90; 90 | 1113.41 | Ireneusz Nowak; Morris J. Robins Synthesis of 3'-Deoxynucleosides with 2-Oxabicyclo[3.1.0]hexane Sugar Moieties: Addition of Difluorocarbene to a 3',4'-Unsaturated Uridine Derivative and 1,2-Dihydrofurans Derived from D- and L-Xylose Journal of Organic Chemistry, 2007, 72, 3319-3325 |
4036923 | CIF | C10 H11 F3 N2 O | P 1 21/c 1 | 8.9513; 4.8424; 25.886 90; 102.982; 90 | 1093.4 | Zhu, Mei; Han, Xin; Fu, Weijun; Wang, Zhiqiang; Ji, Baoming; Hao, Xin-Qi; Song, Mao-Ping; Xu, Chen Regioselective 2,2,2-Trifluoroethylation of Imidazopyridines by Visible Light Photoredox Catalysis. The Journal of organic chemistry, 2016, 81, 7282-7287 |
4034831 | CIF | C10 H11 N O S Se | P 1 21/c 1 | 10.079; 9.9043; 11.905 90; 107.125; 90 | 1135.7 | Shangpliang, O. Risuklang; Kshiar, Baskhemlang; Wanniang, Kmendashisha; Marpna, Ibakyntiew D.; Lipon, Tyrchain Mitre; Laloo, Badaker M.; Myrboh, Bekington Selenium Dioxide As an Alternative Reagent for the Direct α-Selenoamidation of Aryl Methyl Ketones. The Journal of organic chemistry, 2018, 83, 5829-5835 |
4026034 | CIF | C10 H11 N O2 | P 21 21 21 | 9.306; 13.832; 14.42 90; 90; 90 | 1856.2 | Tula B. Bisol; Adailton J. Bortoluzzi; Marcus M. Sá Nucleophilic Ring-Opening of Epoxide and Aziridine Acetates for the Stereodivergent Synthesis of β-Hydroxy and β-Amino γ-Lactams Journal of Organic Chemistry, 2011, 76, 948-962 |
4026035 | CIF | C10 H11 N O2 | P -1 | 8.553; 8.7103; 12.809 80.9; 89.75; 74.15 | 905.7 | Tula B. Bisol; Adailton J. Bortoluzzi; Marcus M. Sá Nucleophilic Ring-Opening of Epoxide and Aziridine Acetates for the Stereodivergent Synthesis of β-Hydroxy and β-Amino γ-Lactams Journal of Organic Chemistry, 2011, 76, 948-962 |
4032328 | CIF | C10 H11 N O2 | P 1 21/c 1 | 11.512; 9.57; 9.098 90; 112.68; 90 | 924.8 | Pigulski, Bartłomiej; Męcik, Patrycja; Cichos, Jakub; Szafert, Sławomir Use of Stable Amine-Capped Polyynes in the Regioselective Synthesis of Push-Pull Thiophenes. The Journal of organic chemistry, 2017, 82, 1487-1498 |
4035052 | CIF | C10 H11 N O2 | P 1 21/c 1 | 15.6648; 6.225; 9.6874 90; 92.105; 90 | 944.01 | Ji, Xiaolei; Gao, Bao; Zhou, Xibing; Liu, Zongjian; Huang, Hanmin Palladium-Catalyzed Regioselective Hydroaminocarbonylation of Alkynes to α,β-Unsaturated Primary Amides with Ammonium Chloride. The Journal of organic chemistry, 2018, 83, 10134-10141 |
4030466 | CIF | C10 H11 N O3 S | P 21 21 21 | 6.364; 12.235; 13.112 90; 90; 90 | 1020.9 | Martinand-Lurin, Elodie; Gruber, Raymond; Retailleau, Pascal; Fleurat-Lessard, Paul; Dauban, Philippe Studies on the formal [3 + 2] cycloaddition of aziridines with alkenes for the synthesis of 1-azaspiroalkanes. The Journal of organic chemistry, 2015, 80, 1414-1426 |
4035256 | CIF | C10 H11 N O3 S | P 21 21 21 | 5.8934; 9.8741; 17.8348 90; 90; 90 | 1037.84 | Kim, Hyeong Rae; Achary, Raghavendra; Lee, Hyeon-Kyu DBU-Promoted Dynamic Kinetic Resolution in Rh-Catalyzed Asymmetric Transfer Hydrogenation of 5-Alkyl Cyclic Sulfamidate Imines: Stereoselective Synthesis of Functionalized 1,2-Amino Alcohols. The Journal of organic chemistry, 2018, 83, 11987-11999 |
4037583 | CIF | C10 H11 N O3 S | P 1 21/n 1 | 5.5475; 22.29; 8.951 90; 92.56; 90 | 1105.7 | Zhao, Peng; Wu, Xia; Geng, Xiao; Wang, Can; Zhou, You; Wu, Yan-Dong; Wu, An-Xin I<sub>2</sub>/PhI(OAc)<sub>2</sub> Copromoted Amination Reaction: Synthesis of α-Dicarbonylsulfoximine Derivatives by Incorporating an Intact Dimethyl Sulfoxide. The Journal of organic chemistry, 2019, 84, 8322-8329 |
4032902 | CIF | C10 H11 N O4 S | P -1 | 7.1934; 7.9479; 9.7888 80.149; 78.645; 89.534 | 540.42 | Chang, Meng-Yang; Chen, Han-Yu; Wang, Heui-Sin Regiocontrolled Synthesis of α-Sulfonylmethyl o-Nitrostyrenes via ZnI2-Mediated Sulfonylation and AgNO2/Pd(PPh3)4-Promoted o-Nitration. The Journal of organic chemistry, 2017, 82, 10601-10610 |
4024057 | CIF | C10 H11 N3 | P b c a | 11.3159; 7.5465; 21.013 90; 90; 90 | 1794.4 | Brendan J. Liddle; Rosalice M. Silva; Tyler J. Morin; Felipe P. Macedo; Ruchi Shukla; Sergey V. Lindeman; James R. Gardinier BORAZANs: Tunable Fluorophores Based on 2-(Pyrazolyl)aniline Chelates of Diphenylboron Journal of Organic Chemistry, 2007, 72, 5637-5646 |
4022633 | CIF | C10 H12 Br F2 N3 O3 | P 21 21 21 | 6.4528; 9.5514; 20.5093 90; 90; 90 | 1264.06 | Ireneusz Nowak; John F. Cannon; Morris J. Robins Addition of Difluorocarbene to 3',4'-Unsaturated Nucleosides: Synthesis of 2'-Deoxy Analogues with a 2-Oxabicyclo[3.1.0]hexane Framework Journal of Organic Chemistry, 2007, 72, 532-537 |
4024619 | CIF | C10 H12 Br N O3 S | P 1 21 1 | 6.2808; 8.2425; 11.701 90; 95.044; 90 | 603.39 | Ali Reza Modarresi-Alam; Homeyra Alsadat Amirazizi; Hajar Bagheri; Hamid-Reza Bijanzadeh; Erich Kleinpeter Dynamic 1H NMR Spectroscopic Study of the Ring Inversion in N-Sulfonyl Morpholines-Studies on N-S Interactions Journal of Organic Chemistry, 2009, 74, 4740-4746 |
4025952 | CIF | C10 H12 Br N3 | P 1 21/c 1 | 8.239; 16.923; 7.936 90; 95.924; 90 | 1100.6 | Dirk Meyer; Thomas Strassner 1,2,4-Triazole-Based Tunable Aryl/Alkyl Ionic Liquids Journal of Organic Chemistry, 2011, 76, 305-308 |
4035645 | CIF | C10 H12 Cl N O S | P 1 21/c 1 | 9.779; 16.269; 7.242 90; 109.31; 90 | 1087.3 | Eriksen, Kristina; Ulfkjær, Anne; Sølling, Theis I; Pittelkow, Michael Benzylic Thio and Seleno Newman-Kwart Rearrangements. The Journal of organic chemistry, 2018, 83, 10786-10797 |
4035646 | CIF | C10 H12 Cl N O S | P n a 21 | 11.91; 4.681; 20.27 90; 90; 90 | 1130 | Eriksen, Kristina; Ulfkjær, Anne; Sølling, Theis I; Pittelkow, Michael Benzylic Thio and Seleno Newman-Kwart Rearrangements. The Journal of organic chemistry, 2018, 83, 10786-10797 |
4024135 | CIF | C10 H12 Cl N O3 | P 1 21 1 | 7.1887; 7.5136; 9.5782 90; 96.1275; 90 | 514.392 | Nicolas Joubert; Radek Pohl; Blanka Klepetářová; Michal Hocek Modular and Practical Synthesis of 6-Substituted Pyridin-3-yl C-Nucleosides Journal of Organic Chemistry, 2007, 72, 6797-6805 |
4025212 | CIF | C10 H12 F3 N O4 | P b c a | 15.151; 8.909; 17.225 90; 90; 90 | 2325 | Alberto Avenoza; Jesús H. Busto; Noelia Canal; Francisco Corzana; Jesús M. Peregrina; Marta Pérez-Fernández; Fernando Rodríguez Cyclobutane Amino Acid Analogues of Furanomycin Obtained by a Formal [2 + 2] Cycloaddition Strategy Promoted by Methylaluminoxane Journal of Organic Chemistry, 2010, 75, 545-552 |
4033630 | CIF | C10 H12 I N5 O4 | P 1 21 1 | 4.962; 13.1568; 10.7648 90; 96.674; 90 | 698.01 | Leonard, Peter; Kondhare, Dasharath; Jentgens, Xenia; Daniliuc, Constantin; Seela, Frank Nucleobase-Functionalized 5-Aza-7-deazaguanine Ribo- and 2'-Deoxyribonucleosides: Glycosylation, Pd-Assisted Cross-Coupling, and Photophysical Properties. The Journal of organic chemistry, 2019, 84, 13313-13328 |
4036650 | CIF | C10 H12 N2 O | P 21 21 21 | 4.3708; 13.7544; 15.5815 90; 90; 90 | 936.72 | Kerisit, Nicolas; Rouxel, Cédric; Colombel-Rouen, Sophie; Toupet, Loïc; Guillemin, Jean-Claude; Trolez, Yann Synthesis, Chemistry, and Photochemistry of Methylcyanobutadiyne in the Context of Space Science. The Journal of organic chemistry, 2016, 81, 3560-3567 |
4023489 | CIF | C10 H12 N2 O2 S | P 1 21/c 1 | 7.5334; 18.0992; 8.462 90; 112.576; 90 | 1065.37 | Young Tak Lee; Young Keun Chung Silver(I)-Catalyzed Facile Synthesis of Pyrazoles From Propargyl N-Sulfonylhydrazones Journal of Organic Chemistry, 2008, 73, 4698-4701 |
4028928 | CIF | C10 H12 N2 O3 | P 43 | 7.9423; 7.9423; 16.974 90; 90; 90 | 1070.7 | Fowler, Sarah A.; Luechapanichkul, Rinrada; Blackwell, Helen E. Synthesis and Characterization of Nitroaromatic Peptoids: Fine Tuning Peptoid Secondary Structure through Monomer Position and Functionality The Journal of Organic Chemistry, 2009, 74, 1440-1449 |
4023442 | CIF | C10 H12 N2 O3 Se | P 21 21 21 | 8.083; 9.186; 14.877 90; 90; 90 | 1104.62 | Dilip K. Tosh; Won Jun Choi; Hea Ok Kim; Yoonji Lee; Shantanu Pal; Xiyan Hou; Jungwon Choi; Sun Choi; Lak Shin Jeong Stereoselective Synthesis and Conformational Study of Novel 2',3'-Didehydro-2',3'-dideoxy-4'-selenonucleosides Journal of Organic Chemistry, 2008, 73, 4259-4262 |
4026769 | CIF | C10 H12 N2 O5 | P c a 21 | 12.2038; 4.1403; 22.3872 90; 90; 90 | 1131.17 | Stephen A. Glover; Jonathan M. White; Adam A. Rosser; Katherine M. Digianantonio Structures of N,N-Dialkoxyamides: Pyramidal Anomeric Amides with Low Amidicity Journal of Organic Chemistry, 2011, 76, 9757-9763 |
4023443 | CIF | C10 H12 N2 O5 Se | P 21 21 21 | 4.95195; 13.432; 16.9083 90; 90; 90 | 1124.65 | Dilip K. Tosh; Won Jun Choi; Hea Ok Kim; Yoonji Lee; Shantanu Pal; Xiyan Hou; Jungwon Choi; Sun Choi; Lak Shin Jeong Stereoselective Synthesis and Conformational Study of Novel 2',3'-Didehydro-2',3'-dideoxy-4'-selenonucleosides Journal of Organic Chemistry, 2008, 73, 4259-4262 |
4032148 | CIF | C10 H12 N2 O8 S2 | P -1 | 6.8561; 7.0999; 7.969 70.08; 88.026; 79.211 | 358.08 | Guo, Ya-Fei; Mahmood, Sajid; Xu, Bao-Hua; Yao, Xiao-Qian; He, Hong-Yan; Zhang, Suo-Jiang Oxidation of Aromatic Aldehydes to Esters: A Sulfate Radical Redox System. The Journal of organic chemistry, 2017, 82, 1591-1599 |
4028238 | CIF | C10 H12 N4 O4 | P n m a | 8.055; 6.578; 22.091 90; 90; 90 | 1170.5 | Xiao-Jian Li; Jin-Ling Zhang; Yu Geng; Zhong Jin Nickel-Catalyzed Suzuki-Miyaura Coupling of Heteroaryl Ethers with Arylboronic Acids Journal of Organic Chemistry, 2013, 78, 5078-5084 |
4032870 | CIF | C10 H12 N8 | P -1 | 4.714; 9.5506; 12.6537 80.792; 86.831; 76.742 | 547.26 | Ahmed, Basil M.; Rudell, Nicholas A.; Soto, Ixtlazihuatl; Mezei, Gellert Reaction of Amines with Aldehydes and Ketones Revisited: Access To a Class of Non-Scorpionate Tris(pyrazolyl)methane and Related Ligands. The Journal of organic chemistry, 2017, 82, 10549-10562 |
4032650 | CIF | C10 H12 O2 | P 65 | 14.7787; 14.7787; 7.6213 90; 90; 120 | 1441.56 | Yan, Qiao; Bolte, Benoit; Bai, Yuhua; Banwell, Martin G.; Willis, Anthony C.; Carr, Paul D. Studies on the Photochemical Rearrangements of Enantiomerically Pure, Polysubstituted, and Variously Annulated Bicyclo[2.2.2]octenones. The Journal of organic chemistry, 2017, 82, 8008-8022 |
4032664 | CIF | C10 H12 O2 | P 21 21 21 | 7.8054; 9.792; 11.058 90; 90; 90 | 845.168 | Yan, Qiao; Bolte, Benoit; Bai, Yuhua; Banwell, Martin G.; Willis, Anthony C.; Carr, Paul D. Studies on the Photochemical Rearrangements of Enantiomerically Pure, Polysubstituted, and Variously Annulated Bicyclo[2.2.2]octenones. The Journal of organic chemistry, 2017, 82, 8008-8022 |
4032985 | CIF | C10 H12 O2 | P 32 | 11.1863; 11.1863; 6.106 90; 90; 120 | 661.7 | Faggyas, Réka J; Calder, Ewen D. D.; Wilson, Claire; Sutherland, Andrew One-Pot Asymmetric Synthesis of Alkylidene 1-Alkylindan-1-ols Using Brønsted Acid and Palladium Catalysis. The Journal of organic chemistry, 2017, 82, 11585-11593 |
4034008 | CIF | C10 H12 O2 | P 1 21/c 1 | 9.0498; 6.4259; 14.3599 90; 100.944; 90 | 819.89 | Lee, Robert; Bashrum, Bryan; Cagle, Ethan C.; Walters, Jillian; Massey, Jake; Zanghi, Monica; Birchfield, Carolyn; French, David; Joy, Jessica; Dos Passos Gomes, Gabriel; Wiget, Paul A. Electronic Donation or Steric Contraction: A Spectroscopic and Structural Analysis of Medium-Sized Constrained Rings for Potential Long-Range Hyperconjugation. The Journal of organic chemistry, 2019, 84, 9897-9906 |
4022506 | CIF | C10 H12 O2 S | P 1 21/n 1 | 6.0917; 15.484; 9.968 90; 99.72; 90 | 926.7 | Chad A. Snyder; John P. Selegue; Eniolami Dosunmu; Nathan C. Tice; Sean Parkin C,O-Dialkylation of Meldrum's Acid: Synthesis and Reactivity of 1,3,7,7-Tetramethyl-4H,10H-6,8,9-trioxa-2-thiabenz[f]azulen-5-one Journal of Organic Chemistry, 2003, 68, 7455-7459 |
4024650 | CIF | C10 H12 O3 | P 1 21/c 1 | 8.1057; 10.616; 10.188 90; 90.7; 90 | 876.6 | Tony V. Robinson; Daniel Sejer Pedersen; Dennis K. Taylor; Edward R. T. Tiekink Dihydroxylation of 4-Substituted 1,2-Dioxines: A Concise Route to Branched Erythro Sugars Journal of Organic Chemistry, 2009, 74, 5093-5096 |
4020340 | CIF | C10 H12 O4 | P 1 21/c 1 | 10.265; 5.715; 16.464 90; 105.233; 90 | 931.9 | Tory N. Cayzer; Michael N. Paddon-Row; Damian Moran; Alan D. Payne; Michael S. Sherburn; Peter Turner Intramolecular Diels-Alder Reactions of Ester Linked 1,3,8-Nonatrienes Journal of Organic Chemistry, 2005, 70, 5561-5570 |
4033529 | CIF | C10 H12 O4 | P 21 21 21 | 6.0477; 7.596; 20.0487 90; 90; 90 | 921 | Xin, Yangchun; Rodríguez-Santiago, Luís; Sodupe, Mariona; Álvarez-Larena, Angel; Busqué, Félix; Alibés, Ramon Intramolecular Photocycloaddition of 2(5 H)-Furanones to Temporarily Tethered Terminal Alkenes as a Stereoselective Source of Enantiomerically Pure Polyfunctionalyzed Cyclobutanes. The Journal of organic chemistry, 2018, 83, 3188-3199 |
4023109 | CIF | C10 H12 O4 S | P 21 21 21 | 7.553; 10.746; 13.435 90; 90; 90 | 1090.4 | Xiao-Ying Xu; Zhuo Tang; Yan-Zhao Wang; Shi-Wei Luo; Lin-Feng Cun; Liu-Zhu Gong Asymmetric Organocatalytic Direct Aldol Reactions of Ketones with α-Keto Acids and Their Application to the Synthesis of 2-Hydroxy-γ-butyrolactones Journal of Organic Chemistry, 2007, 72, 9905-9913 |
4035146 | CIF | C10 H12 O5 | P 1 21/c 1 | 8.392; 19.953; 10.911 90; 94.638; 90 | 1821 | Kaufman, Riley H.; Law, Chunyin M.; Simanis, Justin A.; Woodall, Erica L.; Zwick, 3rd, Christian R; Wedler, Henry B.; Wendelboe, Paul; Hamaker, Christopher G.; Goodell, John R.; Tantillo, Dean J.; Mitchell, T. Andrew Oxidopyrylium-Alkene [5 + 2] Cycloaddition Conjugate Addition Cascade (C<sup>3</sup>) Sequences: Scope, Limitation, and Computational Investigations. The Journal of organic chemistry, 2018, 83, 9818-9838 |
4034861 | CIF | C10 H13 Br2 Cl O | P -1 | 7.4888; 8.8924; 9.2043 83.085; 86.309; 81.87 | 601.67 | Sharp, Phillip P.; Mikusek, Jiri; Ho, Junming; Krenske, Elizabeth H.; Banwell, Martin G.; Coote, Michelle L.; Ward, Jas S.; Willis, Anthony C. Mechanistic Studies on the Base-Promoted Conversion of Alkoxy-Substituted, Ring-Fused gem-Dihalocyclopropanes into Furans: Evidence for a Process Involving Electrocyclic Ring Closure of a Carbonyl Ylide Intermediate. The Journal of organic chemistry, 2018, 83, 13678-13690 |
4037315 | CIF | C10 H13 Cl N3 O3 P | P -1 | 8.5724; 9.5217; 10.0248 64.703; 65.55; 85.194 | 669.1 | Sabat, Nazarii; Poštová Slavětínská, Lenka; Klepetářová, Blanka; Hocek, Michal C-H Phosphonation of Pyrrolopyrimidines: Synthesis of Substituted 7- and 9-Deazapurine-8-phosphonate Derivatives. The Journal of organic chemistry, 2016, 81, 9507-9514 |
4037316 | CIF | C10 H13 Cl N3 O3 P | P -1 | 7.8996; 8.2513; 10.2912 93.736; 97.778; 91.382 | 662.85 | Sabat, Nazarii; Poštová Slavětínská, Lenka; Klepetářová, Blanka; Hocek, Michal C-H Phosphonation of Pyrrolopyrimidines: Synthesis of Substituted 7- and 9-Deazapurine-8-phosphonate Derivatives. The Journal of organic chemistry, 2016, 81, 9507-9514 |
4022190 | CIF | C10 H13 Cl N4 O3 | P -1 | 4.9308; 9.6974; 13.0845 69.191; 84.771; 87.873 | 582.4 | Ahmad Basheer; Zvi Rappoport Substituted 2-Methylene-1,3-oxazolidines, -1,3-thiazolidines, -1,3-benzothiazines, -1,3-oxazines, and Substituted Imidazopyrimidinediones from Cl(CH~2~)~n~NCO and Cl(CH~2~)~n~NCS and Active Methylene Compound Journal of Organic Chemistry, 2006, 71, 9743-9750 |
4023844 | CIF | C10 H13 Cl O2 | P 21 21 21 | 6.0231; 18.026; 18.643 90; 90; 90 | 2024.1 | Xin Cheng; Xuefeng Jiang; Yihua Yu; Shengming Ma Efficient Synthesis of 3-Chloromethyl-2(5H)-furanones and 3-Chloromethyl- 5,6-dihydropyran-2-ones via the PdCl~2~-Catalyzed Chlorocyclocarbonylation of 2,3- or 3,4-Allenols Journal of Organic Chemistry, 2008, 73, 8960-8965 |
4034862 | CIF | C10 H13 Cl3 O | P -1 | 7.3031; 8.917; 9.1413 81.507; 85.452; 80.354 | 579.54 | Sharp, Phillip P.; Mikusek, Jiri; Ho, Junming; Krenske, Elizabeth H.; Banwell, Martin G.; Coote, Michelle L.; Ward, Jas S.; Willis, Anthony C. Mechanistic Studies on the Base-Promoted Conversion of Alkoxy-Substituted, Ring-Fused gem-Dihalocyclopropanes into Furans: Evidence for a Process Involving Electrocyclic Ring Closure of a Carbonyl Ylide Intermediate. The Journal of organic chemistry, 2018, 83, 13678-13690 |
4021620 | CIF | C10 H13 F N2 O3 | P 21 21 21 | 6.3295; 11.365; 13.908 90; 90; 90 | 1000.5 | Zhenhua Sun; Shahadat Ahmed; Larry W. McLaughlin Syntheses of Pyridine C-Nucleosides as Analogues of the Natural Nucleosides dC and dU Journal of Organic Chemistry, 2006, 71, 2922-2925 |
4035104 | CIF | C10 H13 F N2 O6 | P 1 | 5.9682; 7.005; 13.9039 95.289; 93.695; 91.165 | 577.4 | Malek-Adamian, Elise; Patrascu, Mihai Burai; Jana, Sunit Kumar; Martínez-Montero, Saúl; Moitessier, Nicolas; Damha, Masad J. Adjusting the Structure of 2'-Modified Nucleosides and Oligonucleotides via C4'-α-F or C4'-α-OMe Substitution: Synthesis and Conformational Analysis. The Journal of organic chemistry, 2018, 83, 9839-9849 |
4020464 | CIF | C10 H13 F2 N3 O | P 1 21/c 1 | 5.3233; 13.1981; 14.7664 90; 96.62; 90 | 1030.53 | Graham Sandford; Rachel Slater; Dmitrii S. Yufit; Judith A. K. Howard; Antonio Vong Tetrahydropyrido[3,4-b]pyrazine Scaffolds from Pentafluoropyridine Journal of Organic Chemistry, 2005, 70, 7208-7216 |
4037618 | CIF | C10 H13 F3 O2 | P -1 | 5.9984; 12.944; 13.935 66.928; 80.968; 83.515 | 981.5 | Bugera, Maksym; Trofymchuk, Serhii; Tarasenko, Karen; Zaporozhets, Olga; Pustovit, Yurii; Mykhailiuk, Pavel K. Deoxofluorination of Aliphatic Carboxylic Acids: a Route to Trifluoromethyl-Substituted Derivatives. The Journal of organic chemistry, 2019 |
4020181 | CIF | C10 H13 F6 O2 Sb | P -1 | 5.4679; 10.7485; 11.6878 89.132; 81.738; 82.582 | 674.09 | S. V. Lindeman; I. S. Neretin; M. G. Davlieva; J. K. Kochi Journal of Organic Chemistry, 2005, 70, 3263-3266 |
4030412 | CIF | C10 H13 I O2 | P n a 21 | 10.1335; 6.3717; 31.1401 90; 90; 90 | 2010.64 | Olbrich, Martin; Mayer, Peter; Trauner, Dirk Synthetic Studies toward Polytwistane Hydrocarbon Nanorods. The Journal of organic chemistry, 2015, 80, 2042-2055 |
4030413 | CIF | C10 H13 I O2 | P 1 21/c 1 | 6.6232; 9.2703; 16.0938 90; 91.834; 90 | 987.64 | Olbrich, Martin; Mayer, Peter; Trauner, Dirk Synthetic Studies toward Polytwistane Hydrocarbon Nanorods. The Journal of organic chemistry, 2015, 80, 2042-2055 |
4022048 | CIF | C10 H13 I O3 | P 1 21/n 1 | 14.117; 12.342; 6.582 90; 98.8; 90 | 1133.3 | Alexey Y. Koposov; Rashad R. Karimov; Ivan M. Geraskin; Victor N. Nemykin; Viktor V. Zhdankin 2-Iodylphenol Ethers: Preparation, X-ray Crystal Structure, and Reactivity of New Hypervalent Iodine(V) Oxidizing Reagents Journal of Organic Chemistry, 2006, 71, 8452-8458 |
4035647 | CIF | C10 H13 N O Se | P 1 21/n 1 | 5.933; 22.0041; 7.9392 90; 100.687; 90 | 1018.49 | Eriksen, Kristina; Ulfkjær, Anne; Sølling, Theis I; Pittelkow, Michael Benzylic Thio and Seleno Newman-Kwart Rearrangements. The Journal of organic chemistry, 2018, 83, 10786-10797 |
4030321 | CIF | C10 H13 N O2 S | P 1 21 1 | 6.4713; 6.9416; 11.6404 90; 101.765; 90 | 511.92 | Fauber, Benjamin P.; Clagg, Kyle; Gibbons, Paul; Rene, Olivier An Experimental and Computational Study of the Diastereoselective Alkylations of 3-Substituted gamma-Sultams. The Journal of organic chemistry, 2014, 80, 685 |
4035033 | CIF | C10 H13 N O2 S | P 41 21 2 | 11.19566; 11.19566; 16.25033 90; 90; 90 | 2036.86 | Przeslak, Adam D.; Inman, Martyn; Lewis, William; Moody, Christopher J. Origin of the Thiopyrone CTP-431 "Unexpectedly" Isolated from the Marine Sponge Cacospongia mycofijiensis. The Journal of organic chemistry, 2018, 83, 10595-10601 |
4020573 | CIF | C10 H13 N O3 S | P c a 21 | 9.932; 12.608; 8.663 90; 90; 90 | 1084.8 | Ron W. Darbeau; Noe T. Alvarez; Gregory A. Trahan; Frank R. Fronczek Investigating the Reaction of N-Carbobenzoxy-O-carbobenzoxy- hydroxylamine with Dimethyl Sulfoxide: Formation of S,S-Dimethyl-N-[(phenylmethoxy)- carbonyl]sulfoximine. Journal of Organic Chemistry, 2005, 70, 9599-9602 |
4022675 | CIF | C10 H13 N O3 S | P b c a | 14.196; 9.713; 15.483 90; 90; 90 | 2134.9 | N. C. Misra; K. Panda; H. Ila; H. Junjappa An Efficient Highly Regioselective Synthesis of 2,3,4-Trisubstituted Pyrroles by Cycloaddition of Polarized Ketene S,S- and N,S- Acetals with Activated Methylene Isocyanides Journal of Organic Chemistry, 2007, 72, 1246-1251 |
4020231 | CIF | C10 H13 N O4 | P -1 | 13.914; 6.448; 6.075 100.19; 97.74; 87.12 | 531.4 | Alessia Bacchi; Mirco Costa; Nicola Della Cà; Bartolo Gabriele; Giuseppe Salerno; Silvia Cassoni Journal of Organic Chemistry, 2005, 70, 4971-4979 |
4025238 | CIF | C10 H13 N O4 | P 1 21 1 | 7.1895; 6.1491; 11.6112 90; 106.281; 90 | 492.73 | Francis N. Murigi; Gary S. Nichol; Eugene A. Mash Synthesis of the Conformationally Constrained Tyrosine Analogues, (R)- and (S)-5-Hydroxy-2-aminoindan-2-carboxylic Acids Journal of Organic Chemistry, 2010, 75, 1293-1296 |
4020159 | CIF | C10 H13 N O5 | P -1 | 8.167; 10.762; 11.823 103.069; 95.201; 89.954 | 1007.9 | Irishi N. N. Namboothiri; Madhu Ganesh; Shaikh M. Mobin; Miriam Cojocaru Journal of Organic Chemistry, 2005, 70, 2235-2243 |
4022619 | CIF | C10 H13 N3 O2 S | P 1 21/n 1 | 7.0091; 20.9279; 7.8304 90; 103.635; 90 | 1116.24 | Ali Asadi; Brian O. Patrick; David M. Perrin Janus-AT Bases: Synthesis, Self-Assembly, and Solid State Structures Journal of Organic Chemistry, 2007, 72, 466-475 |
4038893 | CIF | C10 H13 N5 | P 1 21/c 1 | 9.27494; 8.81723; 12.0155 90; 92.8415; 90 | 981.41 | Korsik, Marat; Tse, Edwin; Smith, David G.; Lewis, William; Rutledge, Peter J.; Todd, Matthew H. Tele-substitution Reactions in the Synthesis of a Promising Class of 1,2,4-Triazolo[4,3-a]pyrazine-Based Antimalarials. The Journal of organic chemistry, 2020 |
4022969 | CIF | C10 H13 N5 O3 | P 21 21 21 | 7.698; 10.0638; 14.166 90; 90; 90 | 1097.4 | Morris J. Robins; Ireneusz Nowak; Stanislaw F. Wnuk; Fritz Hansske; Danuta Madej Deoxygenative [1,2]-Hydride Shift Rearrangements in Nucleoside and Sugar Chemistry: Analogy with the [1,2]-Electron Shift in the Deoxygenation of Ribonucleotides by Ribonucleotide Reductase Journal of Organic Chemistry, 2007, 72, 8216-8221 |
4021574 | CIF | C10 H13 O P | P 21 21 21 | 8.8844; 9.2378; 11.7132 90; 90; 90 | 961.33 | Marco Oliana; Frank King; Peter N. Horton; M. B. Hursthouse; King Kuok (Mimi) Hii Practical Synthesis of Chiral Vinylphosphine Oxides by Direct Nucleophilic Substitution. Stereodivergent Synthesis of Aminophosphine Ligands Journal of Organic Chemistry, 2006, 71, 2472-2479 |
4023711 | CIF | C10 H14 B N O2 Si | I 1 2/a 1 | 23.951; 8.5113; 23.986 90; 91.92; 90 | 4887 | Sergiusz Luliński; Katarzyna Zajac Selective Generation of Lithiated Benzonitriles: the Importance of Reaction Conditions Journal of Organic Chemistry, 2008, 73, 7785-7788 |
4036173 | CIF | C10 H14 B10 N2 S | P 1 21/c 1 | 18.348; 7.522; 12.006 90; 104.643; 90 | 1603.2 | Kim, So-Yoen; Lee, Ah-Rang; Jin, Guo Fan; Cho, Yang-Jin; Son, Ho-Jin; Han, Won-Sik; Kang, Sang Ook Electronic Alteration on Oligothiophenes by o-Carborane: Electron Acceptor Character of o-Carborane in Oligothiophene Frameworks with Dicyano-Vinyl End-On Group. The Journal of organic chemistry, 2015, 80, 4573-4580 |
4026267 | CIF | C10 H14 Br N O6 | P 1 21/n 1 | 9.8346; 11.6403; 11.3098 90; 112.693; 90 | 1194.49 | Javier Carreras; Alberto Avenoza; Jesús H. Busto; Jesús M. Peregrina Ring-Rearrangement Metathesis of 1-Substituted 7-Azanorbornenes as an Entry to 1-Azaspiro[4.5]decane systems Journal of Organic Chemistry, 2011, 76, 3381-3391 |
4026318 | CIF | C10 H14 Br N3 O4 | P 21 21 21 | 7.575; 7.573; 45.441 90; 90; 90 | 2606.74 | Lara Mata; Gonzalo Jiménez-Osés; Alberto Avenoza; Jesús H. Busto; Jesús M. Peregrina Stereocontrolled Ring-Opening of a Hindered Sulfamidate with Nitrogen-Containing Aromatic Heterocycles: Synthesis of Chiral Quaternary Imidazole Derivatives Journal of Organic Chemistry, 2011, 76, 4034-4042 |
4020845 | CIF | C10 H14 Br2 O2 | P 1 21/c 1 | 5.9571; 14.09; 13.521 90; 96.877; 90 | 1126.7 | Andrew G. Myers; Miki Sogi; Michael A. Lewis; Stephen P. Arvedson Synthetic and Theoretical Studies of Cyclobuta[1,2:3,4]dicyclopentene. Organocobalt Intermediates in the Construction of the Unsaturated Carbon Skeleton and Their Transformation into Novel Cobaltacyclic Complexes by C-C Insertion Journal of Organic Chemistry, 2004, 69, 2516-2525 |
4036454 | CIF | C10 H14 Br2 O3 | P 1 21/c 1 | 6.1597; 24.878; 7.5576 90; 111.066; 90 | 1080.7 | Hooper, Joel F.; James, Natalie C.; Bozkurt, Esra; Aviyente, Viktorya; White, Jonathan M.; Holland, Mareike C.; Gilmour, Ryan; Holmes, Andrew B.; Houk, K. N. Medium-Ring Effects on the Endo/Exo Selectivity of the Organocatalytic Intramolecular Diels-Alder Reaction. The Journal of organic chemistry, 2015, 80, 12058-12075 |
4033362 | CIF | C10 H14 Cl N S | P 21 21 21 | 7.3724; 7.3724; 20.222 90; 90; 90 | 1099.1 | Druzhenko, Tetiana; Skalenko, Yevhen; Samoilenko, Maryna; Denisenko, Aleksandr; Zozulya, Sergey; Borysko, Petro O.; Sokolenko, Maria I.; Tarasov, Alexandr; Mykhailiuk, Pavel K. Photochemical Synthesis of 2-Azabicyclo[3.2.0]heptanes: Advanced Building Blocks for Drug Discovery. Synthesis of 2,3-Ethanoproline. The Journal of organic chemistry, 2018, 83, 1394-1401 |
4037317 | CIF | C10 H14 Cl N4 O3 P | P -1 | 8.221; 10.018; 10.186 113.6; 94.47; 109.16 | 704.6 | Sabat, Nazarii; Poštová Slavětínská, Lenka; Klepetářová, Blanka; Hocek, Michal C-H Phosphonation of Pyrrolopyrimidines: Synthesis of Substituted 7- and 9-Deazapurine-8-phosphonate Derivatives. The Journal of organic chemistry, 2016, 81, 9507-9514 |
4025820 | CIF | C10 H14 Cl O P | P 21 21 21 | 7.9362; 12.0141; 12.061 90; 90; 90 | 1149.97 | Yongbo Zhou; Gang Wang; Yuta Saga; Ruwei Shen; Midori Goto; Yufen Zhao; Li-Biao Han Stereospecific Halogenation of P(O)-H Bonds with Copper(II) Chloride Affording Optically Active Z1Z2P(O)Cl Journal of Organic Chemistry, 2010, 75, 7924-7927 |
4022268 | CIF | C10 H14 F N O3 | P 21 21 21 | 6.439; 7.68; 20.619 90; 90; 90 | 1019.7 | Alan Armstrong; Ghafoor Ahmed; Belén Domínguez-Fernández; Barry R. Hayter; J. Steven Wailes Enantioselective Epoxidation of Alkenes Catalyzed by 2-Fluoro-N-Carbethoxytropinone and Related Tropinone Derivatives Journal of Organic Chemistry, 2002, 67, 8610-8617 |
4026058 | CIF | C10 H14 F12 N2 O2 | P -1 | 5.121; 12.152; 12.407 93.69; 94.64; 96.93 | 761.8 | Daniela Vuluga; Julien Legros; Benoit Crousse; Alexandra M. Z. Slawin; Christian Laurence; Pierre Nicolet; Danièle Bonnet-Delpon Influence of the Structure of Polyfluorinated Alcohols on Brønsted Acidity/Hydrogen-Bond Donor Ability and Consequences on the Promoter Effect Journal of Organic Chemistry, 2011, 76, 1126-1133 |
4037865 | CIF | C10 H14 N2 O Se | P 1 21/c 1 | 5.731; 9.8325; 21.1541 90; 97.167; 90 | 1182.72 | Vyhivskyi, Oleksandr; Laikov, Dimitri N.; Finko, Alexander V.; Skvortsov, Dmitry A.; Zhirkina, Irina V.; Tafeenko, Victor Aleksandrovich; Zyk, Nikolay Vasil'evich; Majouga, Alexander G.; Beloglazkina, Elena K. Ullmann-type C-Se cross-coupling in the hydantoin family: Synthesis, mechanistic studies, and tests of biological activity. The Journal of organic chemistry, 2020 |
4022286 | CIF | C10 H14 N2 O3 S2 | P 21 21 21 | 5.7703; 13.323; 15.976 90; 90; 90 | 1228.2 | Jun-ya Chiba; Kentaro Tanaka; Yukinori Ohshiro; Ryosuke Miyake; Shuichi Hiraoka; Motoo Shiro; Mitsuhiko Shionoya Artificial Nucleosides Possessing Metal Binding Sites at the 3'- and 5'-Positions of the Deoxyribose Moieties Journal of Organic Chemistry, 2003, 68, 331-338 |
4034902 | CIF | C10 H14 N2 O5 | P 21 21 21 | 5.6312; 13.6957; 15.9894 90; 90; 90 | 1233.15 | Richardson, Mark B.; Brown, Derek B.; Vasquez, Carlos A.; Ziller, Joseph W.; Johnston, Kevin M.; Weiss, Gregory A. Synthesis and Explosion Hazards of 4-Azido-l-phenylalanine. The Journal of organic chemistry, 2018, 83, 4525-4536 |
4037961 | CIF | C10 H14 N2 O6 | P 1 21 1 | 8.35326; 5.76025; 11.5435 90; 95.1416; 90 | 553.202 | Köllmann, Christoph; Sake, Svenja M.; Jones, Peter G.; Pietschmann, Thomas; Werz, Daniel B. Protecting-Group-Mediated Diastereoselective Synthesis of C4'-Methylated Uridine Analogs and their Activity against the Human Respiratory Syncytial Virus. The Journal of organic chemistry, 2020 |
4038650 | CIF | C10 H14 O | P 1 21 1 | 12.2177; 12.0514; 12.2819 90; 90.36; 90 | 1808.36 | Sun, Yuli; Lu, Chengrong; Zhao, Bei; Xue, Mingqiang Enantioselective Hydroboration of Ketones Catalyzed by Rare-Earth Metal Complexes Containing Trost Ligands. The Journal of organic chemistry, 2020 |
4020341 | CIF | C10 H14 O2 | C 1 c 1 | 5.439; 15.375; 10.6474 90; 98.727; 90 | 880.1 | Tory N. Cayzer; Michael N. Paddon-Row; Damian Moran; Alan D. Payne; Michael S. Sherburn; Peter Turner Intramolecular Diels-Alder Reactions of Ester Linked 1,3,8-Nonatrienes Journal of Organic Chemistry, 2005, 70, 5561-5570 |
4020343 | CIF | C10 H14 O2 | C 1 c 1 | 12.177; 9.0889; 8.1797 90; 98.466; 90 | 895.5 | Tory N. Cayzer; Michael N. Paddon-Row; Damian Moran; Alan D. Payne; Michael S. Sherburn; Peter Turner Intramolecular Diels-Alder Reactions of Ester Linked 1,3,8-Nonatrienes Journal of Organic Chemistry, 2005, 70, 5561-5570 |
4021605 | CIF | C10 H14 O2 S2 | P 1 21/c 1 | 9.7096; 9.007; 12.966 90; 110.406; 90 | 1062.77 | Helen F. Sneddon; Alexandra van den Heuvel; Anna K. H. Hirsch; Richard A. Booth; David M. Shaw; Matthew J. Gaunt; Steven V. Ley Double Conjugate Addition of Dithiols to Propargylic Carbonyl Systems To Generate Protected 1,3-Dicarbonyl Compounds Journal of Organic Chemistry, 2006, 71, 2715-2725 |
4023220 | CIF | C10 H14 O3 | P n a 21 | 12.024; 10.6931; 7.1249 90; 90; 90 | 916.1 | Bernd Schetter; Burkhard Ziemer; Gregor Schnakenburg; Rainer Mahrwald Tetranuclear BINOL-Titanium Complex in Selective Direct Aldol Additions Journal of Organic Chemistry, 2008, 73, 813-819 |
4024430 | CIF | C10 H14 O4 | P 1 21 1 | 10.036; 9.173; 10.955 90; 90.174; 90 | 1008.6 | C. V. Ramana; Sharad B. Suryawanshi; Rajesh G. Gonnade Pd(II)-Mediated Alkynediol Spiroketalization: First Total Synthesis of (-)-Cephalosporolide E and (+)-Cephalosporolide F Journal of Organic Chemistry, 2009, 74, 2842-2845 |
4028710 | CIF | C10 H14 O4 | P 1 21 1 | 8.4976; 5.2988; 11.0339 90; 93.476; 90 | 495.91 | Dominik Hager; Christian Paulitz; Jörg Tiebes; Peter Mayer; Dirk Trauner Total Synthesis of Herbicidin C and Aureonuclemycin: Impasses and New Avenues Journal of Organic Chemistry, 2013, 78, 10784-10801 |
4032020 | CIF | C10 H14 O4 | P 21 21 21 | 6.968; 8.073; 17.744 90; 90; 90 | 998.1 | Clay, Julia M.; Hesek, Dusan; Oliver, Allen G.; Lee, Mijoon; Fisher, Jed F. Ensemble of Pinanones from the Permanganate Oxidation of Myrtenal. The Journal of organic chemistry, 2016, 81, 5705-5709 |
4024429 | CIF | C10 H14 O5 | P 1 21 1 | 7.258; 8.97; 8.41 90; 110.889; 90 | 511.5 | C. V. Ramana; Sharad B. Suryawanshi; Rajesh G. Gonnade Pd(II)-Mediated Alkynediol Spiroketalization: First Total Synthesis of (-)-Cephalosporolide E and (+)-Cephalosporolide F Journal of Organic Chemistry, 2009, 74, 2842-2845 |
4028712 | CIF | C10 H14 O5 | P 21 21 21 | 7.1089; 7.2805; 20.2476 90; 90; 90 | 1047.94 | Dominik Hager; Christian Paulitz; Jörg Tiebes; Peter Mayer; Dirk Trauner Total Synthesis of Herbicidin C and Aureonuclemycin: Impasses and New Avenues Journal of Organic Chemistry, 2013, 78, 10784-10801 |
4020500 | CIF | C10 H15 Cl O | I 41/a :2 | 23.604; 23.604; 13.515 90; 90; 90 | 7530 | María E. González Núñez; Jorge Royo; Rossella Mello; Minerva Báguena; Jaime Martínez Ferrer; Carmen Ramírez de Arellano; Gregorio Asensio; G. K. Surya Prakash Oxygenation of Alkane C-H Bonds with Methyl(trifluoromethyl)dioxirane: Effect of the Substituents and the Solvent on the Reaction Rate Journal of Organic Chemistry, 2005, 70, 7919-7924 |
4027061 | CIF | C10 H15 Cl8 Ir O5 Sn3 | P 1 21/a 1 | 9.5026; 34.1358; 9.7418 90; 116.922; 90 | 2817.6 | Arnab Kumar Maity; Sujit Roy A Multimetallic Piano-Stool Ir-Sn3 Catalyst for Nucleophilic Substitution Reaction of γ-Hydroxy Lactams through N-Acyliminium Ions Journal of Organic Chemistry, 2012, 77, 2935-2941 |
4035102 | CIF | C10 H15 F N2 O7 | C 1 2 1 | 30.0065; 6.5012; 13.4207 90; 108.954; 90 | 2476.1 | Malek-Adamian, Elise; Patrascu, Mihai Burai; Jana, Sunit Kumar; Martínez-Montero, Saúl; Moitessier, Nicolas; Damha, Masad J. Adjusting the Structure of 2'-Modified Nucleosides and Oligonucleotides via C4'-α-F or C4'-α-OMe Substitution: Synthesis and Conformational Analysis. The Journal of organic chemistry, 2018, 83, 9839-9849 |
4023776 | CIF | C10 H15 N O | P 21 21 21 | 6.2729; 11.291; 12.464 90; 90; 90 | 882.8 | Shamim Ahmed; Luke A. Baker; Richard S. Grainger; Paolo Innocenti; Camilo E. Quevedo Thermal Elimination of Diethyldithiocarbamates and Application in the Synthesis of (±)-Ferrugine Journal of Organic Chemistry, 2008, 73, 8116-8119 |
4020980 | CIF | C10 H15 N O2 | P 1 21/c 1 | 13.6734; 5.967; 11.9961 90; 109.494; 90 | 922.65 | Steven M. Sparks; Chun P. Chow; Liang Zhu; Kenneth J. Shea Type 2 Intramolecular N-Acylnitroso Diels-Alder Reaction: Scope and Application to the Synthesis of Medium Ring Lactams Journal of Organic Chemistry, 2004, 69, 3025-3035 |
4026133 | CIF | C10 H15 N O2 S | P 21 21 2 | 6.9899; 22.4792; 6.8185 90; 90; 90 | 1071.37 | Donn G. Wishka; Marion Bédard; Katherine E. Brighty; Richard A. Buzon; Kathleen A. Farley; Michael W. Fichtner; Goss S. Kauffman; Jaap Kooistra; Jason G. Lewis; Hardwin O'Dowd; Ivan J. Samardjiev; Brian Samas; Geeta Yalamanchi; Mark C. Noe An Asymmetric Synthesis of (2S,5S)-5-Substituted Azepane-2-Carboxylate Derivatives Journal of Organic Chemistry, 2011, 76, 1937-1940 |
4020011 | CIF | C10 H15 N O3 | C 2 2 21 | 10.6675; 11.0586; 16.5092 90; 90; 90 | 1947.55 | Mingshi Dai; Xuqing Zhang; Seock-Kyu Khim; Arthur G. Schultz Journal of Organic Chemistry, 2005, 70, 384-387 |
4024023 | CIF | C10 H15 N O3 | P 21 21 21 | 7.6149; 8.552; 16.5755 90; 90; 90 | 1079.4 | Arnaud Voituriez; Franck Ferreira; Fabrice Chemla Short and Efficient Asymmetric Synthesis of (-)-α-Conhydrine Journal of Organic Chemistry, 2007, 72, 5358-5361 |
4033289 | CIF | C10 H15 N O3 | P 1 21/n 1 | 9.1273; 9.0984; 13.1203 90; 109.613; 90 | 1026.35 | Chang, Zong; Boyaud, France; Guillot, Régis; Boddaert, Thomas; Aitken, David J. A Photochemical Route to 3- and 4-Hydroxy Derivatives of 2-Aminocyclobutane-1-carboxylic Acid with an all-cis Geometry. The Journal of organic chemistry, 2017 |
4025211 | CIF | C10 H15 N O4 | P 1 21/c 1 | 11.828; 8.994; 10.1781 90; 105.906; 90 | 1041.3 | Alberto Avenoza; Jesús H. Busto; Noelia Canal; Francisco Corzana; Jesús M. Peregrina; Marta Pérez-Fernández; Fernando Rodríguez Cyclobutane Amino Acid Analogues of Furanomycin Obtained by a Formal [2 + 2] Cycloaddition Strategy Promoted by Methylaluminoxane Journal of Organic Chemistry, 2010, 75, 545-552 |
4033040 | CIF | C10 H15 N O4 | P -1 | 5.5617; 9.7074; 10.4167 88.569; 85.582; 77.614 | 547.65 | Feskov, Illia O.; Chernykh, Anton V.; Kondratov, Ivan S.; Klyachina, Mariya; Daniliuc, Constantin G.; Haufe, Günter Cyclobutyl-Containing Rigid Analogues of Threonine: Synthesis and Physical Chemical Properties. The Journal of organic chemistry, 2017, 82, 12863-12868 |
4024183 | CIF | C10 H15 N S3 | P 1 21/n 1 | 6.7373; 12.9144; 14.3355 90; 101.895; 90 | 1220.52 | Victor Mamane; Emmanuel Aubert; Yves Fort The Methyl Group as a Source of Structural Diversity in Heterocyclic Chemistry: Side Chain Functionalization of Picolines and Related Heterocycles Journal of Organic Chemistry, 2007, 72, 7294-7300 |
4028465 | CIF | C10 H15 N3 O | P 1 21/n 1 | 12.8161; 5.1702; 15.4402 90; 92.666; 90 | 1021.99 | Borys Ośmiałowski; Karina Mroczyńska; Erkki Kolehmainen; Magdalena Kowalska; Arto Valkonen; Marek Pietrzak; Kari Rissanen Association of N-(Pyridin-2-yl),N'-substituted Ureas with 2-Amino-1,8-naphthyridines and Benzoates: NMR and Quantum Chemical Studies of the Substituent Effect on Complexation Journal of Organic Chemistry, 2013, 78, 7582-7593 |
4023265 | CIF | C10 H15 N3 O S | P -1 | 7.5503; 8.2831; 10.0876 86.381; 69.409; 85.586 | 588.38 | Ahmad Basheer; Zvi Rappoport A Rich Array of Reactions of Cyanomonothiocarbonylmalonamides RNHCSCH(CN)CONHR' and Their Thioenols RNHC(SH)=C(CN)CONHR' Journal of Organic Chemistry, 2008, 73, 1386-1396 |
4021125 | CIF | C10 H15 N3 O8 | P 1 21 1 | 9.23; 7.452; 18.389 90; 95.39; 90 | 1259.3 | Jinhua Chen; Thota Sambaiah; Boris Illarionov; Markus Fischer; Adelbert Bacher; Mark Cushman Design, Synthesis, and Evaluation of Acyclic C-Nucleoside and N-Methylated Derivatives of the Ribitylaminopyrimidine Substrate of Lumazine Synthase as Potential Enzyme Inhibitors and Mechanistic Probes Journal of Organic Chemistry, 2004, 69, 6996-7003 |
4024781 | CIF | C10 H15 N5 O4 | P 1 21 1 | 4.6791; 7.8457; 16.084 90; 96.666; 90 | 586.45 | Thomas E. Storr; Christoph G. Baumann; Robert J. Thatcher; Sara De Ornellas; Adrian C. Whitwood; Ian J. S. Fairlamb Pd(0)/Cu(I)-Mediated Direct Arylation of 2'-Deoxyadenosines: Mechanistic Role of Cu(I) and Reactivity Comparisons with Related Purine Nucleosides Journal of Organic Chemistry, 2009, 74, 5810-5821 |
4022227 | CIF | C10 H15 P S | P 1 21/n 1 | 9.085; 11.004; 10.314 90; 103.309; 90 | 1003.5 | Eric Mattmann; François Mercier; Louis Ricard; François Mathey Synthesis of New Tricyclic Phosphines and Phosphinites by Intramolecular Diels-Alder Reactions of Trivalent Phospholes Journal of Organic Chemistry, 2002, 67, 5422-5425 |
4035339 | CIF | C10 H16 F2 O2 | P n a a | 9.904; 22.127; 9.113 90; 90; 90 | 1997.1 | McCarter, Adam W.; Sommer, Magdalena; Percy, Jonathan M.; Jamieson, Craig; Kennedy, Alan R.; Hirst, David J. Atom Efficient Synthesis of Selectively Difluorinated Carbocycles through a Gold(I)-Catalyzed Cyclization. The Journal of organic chemistry, 2018, 83, 8888-8905 |
4038611 | CIF | C10 H16 F3 N O6 | P 21 21 21 | 8.8728; 11.3215; 13.0054 90; 90; 90 | 1306.44 | Ben Jamaa, Abdelkhalek; Latrache, Mohammed; Riguet, Emmanuel; Grellepois, Fabienne cis-Dihydroxylated α-Trifluoromethylated N,O-Acetal from l-Tartaric Acid: Synthesis of Tetrasubstituted Stereocenter via Diastereoselective Pictet-Spengler Cyclization of N-Acyliminium Ions The Journal of Organic Chemistry, 2020 |
4032401 | CIF | C10 H16 N2 O3 | P -1 | 7.2069; 7.742; 9.5826 80.466; 79.403; 77.127 | 507.99 | Maier, Lukáš; Khirsariya, Prashant; Hylse, Ondřej; Adla, Santosh Kumar; Černová, Lenka; Poljak, Michal; Krajčovičová, Soňa; Weis, Erik; Drápela, Stanislav; Souček, Karel; Paruch, Kamil Diastereoselective Flexible Synthesis of Carbocyclic C-Nucleosides. The Journal of organic chemistry, 2017, 82, 3382-3402 |
4033648 | CIF | C10 H16 N2 O6 Se | P 21 21 21 | 6.7185; 7.05778; 27.0126 90; 90; 90 | 1280.88 | Lee, Hyejin; Jarhad, Dnyandev B.; Yu, Jinha; Lee, Choongho; Jeong, Lak Shin Asymmetric Synthesis of 2'-<i>C</i>-Methyl-4'-selenonucleosides as Anti-Hepatitis C Virus Agents. The Journal of organic chemistry, 2019 |
4037202 | CIF | C10 H16 N4 O4 | P n a 21 | 9.49728; 21.3932; 6.35861 90; 90; 90 | 1291.92 | Nourian, Saghar; Zilber, Zachary A.; Toscano, John P. Development of N-Substituted Hydroxamic Acids with Pyrazolone Leaving Groups as Nitrosocarbonyl Precursors. The Journal of organic chemistry, 2016, 81, 9138-9146 |
4037203 | CIF | C10 H16 N4 O5 | P 1 21 1 | 9.44384; 6.72231; 10.34284 90; 96.4986; 90 | 652.39 | Nourian, Saghar; Zilber, Zachary A.; Toscano, John P. Development of N-Substituted Hydroxamic Acids with Pyrazolone Leaving Groups as Nitrosocarbonyl Precursors. The Journal of organic chemistry, 2016, 81, 9138-9146 |
4021210 | CIF | C10 H16 O2 | C 1 c 1 | 16.729; 5.8591; 11.03 90; 124.594; 90 | 890 | Gregory R. Dake; Michaël D. B. Fenster; Mélissa Fleury; Brian O. Patrick Investigations of α-Siloxy-Epoxide Ring Expansions Forming 1-Azaspirocyclic Ketones Journal of Organic Chemistry, 2004, 69, 5676-5683 |
4021045 | CIF | C10 H16 O3 | P c 21 n | 7.2339; 7.5773; 17.8539 90; 90; 90 | 978.6 | David M. Hodgson; Frédéric Le Strat; Thomas D. Avery; Andrew C. Donohue; Tobias Brückl Stereocontrolled Syntheses of the Nemorensic Acids Using 6-Diazoheptane-2,5-dione in Carbonyl Ylide Cycloadditions Journal of Organic Chemistry, 2004, 69, 8796-8803 |
4025598 | CIF | C10 H16 O3 | P 1 21 1 | 10.4645; 9.8531; 11.5532 90; 115.814; 90 | 1072.36 | Stephen Hanessian; Thilo Focken; Xueling Mi; Rupal Oza; Bin Chen; Dougal Ritson; Renaud Beaudegnies Total Synthesis of (+)-Ambruticin S: Probing the Pharmacophoric Subunit Journal of Organic Chemistry, 2010, 75, 5601-5618 |
4031307 | CIF | C10 H16 O3 | P 21 21 21 | 6.9872; 11.6575; 11.8586 90; 90; 90 | 965.92 | Ramesh, Remya; Bell, Vaughn; Twidle, Andrew M.; Gonnade, Rajesh; Reddy, D. Srinivasa Enantiospecific Synthesis of Both Enantiomers of the Longtailed Mealybug Pheromone and Their Evaluation in a New Zealand Vineyard. The Journal of organic chemistry, 2015, 80, 7785-7789 |
4026972 | CIF | C10 H16 O4 | P b c a | 10.477; 15.019; 13.2317 90; 90; 90 | 2082.1 | Alexander O. Terent'ev; Ivan A. Yaremenko; Vladimir V. Chernyshev; Valery M. Dembitsky; Gennady I. Nikishin Selective Synthesis of Cyclic Peroxides from Triketones and H2O2 Journal of Organic Chemistry, 2012, 77, 1833-1842 |
4030997 | CIF | C10 H16 O4 | P 1 21 1 | 11.711; 5.8434; 15.8296 90; 97.347; 90 | 1074.36 | Mondal, Mukulesh; Chen, Shi; Othman, Nabil; Wheeler, Kraig A.; Kerrigan, Nessan J. Phosphine-Catalyzed Diastereoselective Synthesis of β-Lactones from Disubstituted Ketenes and α-Chiral Oxyaldehydes. The Journal of organic chemistry, 2015, 80, 5789-5794 |
4038657 | CIF | C10 H16 O4 | P 1 | 9.5884; 14.8739; 15.0818 90.941; 94.795; 102.677 | 2089.8 | Cornelius, Lyndon A. M.; Li, Jianqing; Smith, Daniel; Krishnananthan, Subramaniam; Yip, Shiuhang; Wu, Dauh-Rurng; Pawluczyk, Joseph; Aulakh, Darpandeep; Sarjeant, Amy A.; Kempson, James; Tino, Joseph A.; Mathur, Arvind; Dhar, T. G. Murali; Cherney, Robert J. Synthesis of 1-(tert-Butyl) 4-Methyl (1R,2S,4R)-2-Methylcyclohexane-1,4-Dicarboxylate from Hagemann's tert-Butyl Ester for an Improved Synthesis of BMS-986251. The Journal of organic chemistry, 2020 |
4021044 | CIF | C10 H16 O5 | P c a b | 10.9443; 12.8927; 31.0269 90; 90; 90 | 4377.9 | David M. Hodgson; Frédéric Le Strat; Thomas D. Avery; Andrew C. Donohue; Tobias Brückl Stereocontrolled Syntheses of the Nemorensic Acids Using 6-Diazoheptane-2,5-dione in Carbonyl Ylide Cycloadditions Journal of Organic Chemistry, 2004, 69, 8796-8803 |
4027002 | CIF | C10 H16 O5 | P 1 21 1 | 7.5846; 5.833; 11.8172 90; 90.213; 90 | 522.8 | Paresh M. Vadhadiya; Vedavati G. Puranik; C. V. Ramana The Total Synthesis and Structural Revision of Stagonolide D Journal of Organic Chemistry, 2012, 77, 2169-2175 |
4028709 | CIF | C10 H16 O5 | P 1 | 6.0447; 6.9522; 7.2801 72.905; 71.641; 69.728 | 266.45 | Dominik Hager; Christian Paulitz; Jörg Tiebes; Peter Mayer; Dirk Trauner Total Synthesis of Herbicidin C and Aureonuclemycin: Impasses and New Avenues Journal of Organic Chemistry, 2013, 78, 10784-10801 |
4029043 | CIF | C10 H16 O5 | P 21 21 21 | 5.5597; 8.6192; 21.5904 90; 90; 90 | 1034.62 | Song, Liyan; Lee, Ka-Ho; Lin, Zhenyang; Tong, Rongbiao Structural Revision of Cephalosporolide J and Bassianolone. The Journal of organic chemistry, 2014, 79, 1493 |
4034917 | CIF | C10 H16 O5 | P 1 21/n 1 | 8.255; 8.7337; 15.3572 90; 104.438; 90 | 1072.24 | Yaremenko, Ivan A.; Gomes, Gabriel Dos Passos; Radulov, Peter S.; Belyakova, Yulia Yu; Vilikotskiy, Anatoliy E.; Vil', Vera A.; Korlyukov, Alexander A.; Nikishin, Gennady I.; Alabugin, Igor V.; Terent'ev, Alexander O. Ozone-Free Synthesis of Ozonides: Assembling Bicyclic Structures from 1,5-Diketones and Hydrogen Peroxide. The Journal of organic chemistry, 2018, 83, 4402-4426 |
4034608 | CIF | C10 H17 Cl N2 O2 | P 1 21 1 | 6.6026; 16.0983; 11.7124 90; 103.279; 90 | 1211.63 | Amer, Mostafa Mahmoud; Abas, Hossay; Leonard, Daniel J.; Ward, John W.; Clayden, Jonathan Amino Acid-Derived trans- N-Chloroformylimidazolidinones: Scalable, Stereoselective Synthesis, Structure, and Utility. The Journal of organic chemistry, 2019, 84, 7199-7206 |
4023476 | CIF | C10 H17 F N2 O | P 1 21/c 1 | 7.539; 10.017; 14.621 90; 91.27; 90 | 1103.9 | Takeshi Hanamoto; Eri Hashimoto; Masayuki Miura; Hiroshi Furuno; Junji Inanaga Reaction of N-Methyl-5-tributylstannyl-4-fluoro-1H-pyrazole and its Application to N-Methyl-chromeno[2,3-d]pyrazol-9-one Synthesis Journal of Organic Chemistry, 2008, 73, 4736-4739 |
4021477 | CIF | C10 H17 N O | P 1 | 6.2686; 8.196; 6.084 111.81; 101.01; 110.62 | 252.3 | Fraser F. Fleming; Zhiyu Zhang; Guoqing Wei; Omar W. Steward C-Metalated Nitriles: Electrophile-Dependent Alkylations and Acylations Journal of Organic Chemistry, 2006, 71, 1430-1435 |
4021535 | CIF | C10 H17 N O4 | P 1 21/c 1 | 7.1537; 17.2234; 9.5554 90; 96.095; 90 | 1170.68 | Gonzalo Jiménez-Osés; Francisco Corzana; Jesús H. Busto; Marta Pérez-Fernández; Jesús M. Peregrina; Alberto Avenoza Conformational Analysis of 2-Substituted Cyclobutane‒amino Acid Derivatives. A Synergistic Experimental and Computational Study Journal of Organic Chemistry, 2006, 71, 1869-1878 |
4030543 | CIF | C10 H17 N O4 | P 21 21 21 | 7.6184; 9.1016; 15.0206 90; 90; 90 | 1041.52 | Das, Soumendra Nath; Chowdhury, Arpan; Tripathi, Neha; Jana, Prithwish K.; Mandal, Sukhendu B. Exploitation of in Situ Generated Sugar-Based Olefin Keto-Nitrones: Synthesis of Carbocycles, Heterocycles, and Nucleoside Derivatives. The Journal of organic chemistry, 2014, 80, 1136 |
4020025 | CIF | C10 H17 N O5 | P 1 21/c 1 | 15.0571; 8.5111; 9.6337 90; 105.119; 90 | 1191.88 | Alberto Avenoza; Jesus H Busto; Noelia Canal; Jesus M Peregrina Journal of Organic Chemistry, 2005, 70, 330-333 |
4021533 | CIF | C10 H17 N O5 | P n a 21 | 9.37; 13.6508; 9.424 90; 90; 90 | 1205.4 | Gonzalo Jiménez-Osés; Francisco Corzana; Jesús H. Busto; Marta Pérez-Fernández; Jesús M. Peregrina; Alberto Avenoza Conformational Analysis of 2-Substituted Cyclobutane‒amino Acid Derivatives. A Synergistic Experimental and Computational Study Journal of Organic Chemistry, 2006, 71, 1869-1878 |
4035092 | CIF | C10 H17 N O5 | P 1 21 1 | 5.976; 9.0579; 10.1215 90; 91.597; 90 | 547.66 | Liang, Yu-Fu; Chung, Chuang-Chung; Liao, De-Jhong; Lee, Woo-Jer; Tu, Yu-Wei; Uang, Biing-Jiun Total Syntheses of (+)-α-Allokainic Acid and (-)-2- epi-α-Allokainic Acid Employing Ketopinic Amide as a Chiral Auxiliary. The Journal of organic chemistry, 2018, 83, 10564-10572 |
4022445 | CIF | C10 H17 N3 O | P 1 21/c 1 | 10.6922; 9.834; 10.9612 90; 115.541; 90 | 1039.9 | Franciszek Sączewski; Jarosław Sączewski; Maria Gdaniec Synthesis, Molecular Structure, and Applications of 2-Hydroxylamino-4,5-dihydroimidazolium-O-sulfonate to the Synthesis of Novel Heterocyclic Ring Systems Journal of Organic Chemistry, 2003, 68, 4791-4796 |
4024035 | CIF | C10 H17 N3 O2 | P 1 21/n 1 | 9.929; 11.108; 11.655 90; 108.274; 90 | 1220.7 | Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport Enols of Substituted Cyanomalonamides Journal of Organic Chemistry, 2007, 72, 5297-5312 |
4024106 | CIF | C10 H17 N3 O5 | P 1 | 8.083; 11.4021; 14.4056 92.201; 90.443; 104.495 | 1284.3 | Olivier Loiseleur; Dougal Ritson; Mafalda Nina; Patrick Crowley; Trixie Wagner; Stephen Hanessian Ring-Modified Analogues and Molecular Dynamics Studies To Probe the Requirements for Fungicidal Activities of Malayamycin A and Its N-Nucleoside Variants Journal of Organic Chemistry, 2007, 72, 6353-6363 |
4023194 | CIF | C10 H17 N4 O S | P 1 21/c 1 | 7.2974; 15.2206; 11.3294 90; 103.27; 90 | 1224.8 | Julya F. Polienko; Thomas Schanding; Yury V. Gatilov; Igor A. Grigor'ev; Maxim A. Voinov Studies toward the Synthesis of 4-(2-R-ethyl)amino-2,2,5,5-tetramethyl-3-imidazoline 1-Oxyls. Nucleophilic Substitution of Bromide in the N-Alkyl Chain of the 1,2,4-Oxadiazol-2-one Precursor Journal of Organic Chemistry, 2008, 73, 502-510 |
4028653 | CIF | C10 H18 Br N | P 21 21 21 | 8.615; 10.6071; 11.8897 90; 90; 90 | 1086.48 | Zachary D. Aron; Tatsuya Ito; Tricia L. May; Larry E. Overman; Jocelyn Wang Enantioselective Synthesis of Angularly Substituted 1-Azabicylic Rings: Coupled Dynamic Kinetic Epimerization and Chirality Transfer Journal of Organic Chemistry, 2013, 78, 9929-9948 |
4034522 | CIF | C10 H18 Cl N O | P n a 21 | 24.981; 7.1333; 12.15 90; 90; 90 | 2165.1 | Sokolenko, Yevhenii M.; Yurov, Yevhen Yu; Vashchenko, Bohdan V.; Hryshchuk, Oleksandr V.; Filimonova, Yuliia; Ostapchuk, Eugeniy N.; Artemenko, Artem; Zaremba, Oleg V.; Grygorenko, Oleksandr O. Far Away from Flatland. Synthesis and Molecular Structure of Dihetera[3.3.<i>n</i>]propellanes and Trihetera[3.3.<i>n</i>]propellanes: Advanced Analogues of Morpholine/Piperazine. The Journal of organic chemistry, 2019, 84, 13908-13921 |
4028748 | CIF | C10 H18 Cl N2 O4 P | P 43 21 2 | 8.2039; 8.2039; 21.191 90; 90; 90 | 1426.2 | Shuxia Cao; Peng Gao; Yanchun Guo; Huamin Zhao; Jun Wang; Yifan Liu; Yufen Zhao Unexpected Insertion of CO2 into the Pentacoordinate P-N Bond: Atherton-Todd-Type Reaction of Hydrospirophosphorane with Amines Journal of Organic Chemistry, 2013, 78, 11283-11293 |
4028549 | CIF | C10 H18 F N O3 | P 1 21 1 | 7.7674; 8.7329; 8.4874 90; 97.962; 90 | 570.167 | Simon J. Shaw; Dane A. Goff; Luke A. Boralsky; Mark Irving; Rajinder Singh Enantioselective Synthesis of cis-3-Fluoropiperidin-4-ol, a Building Block for Medicinal Chemistry Journal of Organic Chemistry, 2013, 78, 8892-8897 |
4028550 | CIF | C10 H18 F N O3 | P 1 21 1 | 7.7639; 8.7343; 8.4835 90; 98.013; 90 | 569.67 | Simon J. Shaw; Dane A. Goff; Luke A. Boralsky; Mark Irving; Rajinder Singh Enantioselective Synthesis of cis-3-Fluoropiperidin-4-ol, a Building Block for Medicinal Chemistry Journal of Organic Chemistry, 2013, 78, 8892-8897 |
4028732 | CIF | C10 H18 N O2 | P 1 21/c 1 | 9.259; 6.367; 18.158 90; 97.41; 90 | 1061.5 | Yu Peng; Long Luo; Chang-Song Yan; Jian-Jian Zhang; Ya-Wen Wang Ni-Catalyzed Reductive Homocoupling of Unactivated Alkyl Bromides at Room Temperature and Its Synthetic Application Journal of Organic Chemistry, 2013, 78, 10960-10967 |
4033807 | CIF | C10 H18 N2 O2 | P 43 21 2 | 9.4429; 9.4429; 24.644 90; 90; 90 | 2197.5 | Tanaka, Kouichi; Miki, Takashi; Murata, Kunihiko; Yamaguchi, Ayumi; Kayaki, Yoshihito; Kuwata, Shigeki; Ikariya, Takao; Watanabe, Masahito Reductive Amination of Ketonic Compounds Catalyzed by Cp*Ir(III) Complexes Bearing a Picolinamidato Ligand. The Journal of organic chemistry, 2019, 84, 10962-10977 |
4021472 | CIF | C10 H18 N2 O5 S | P 21 21 21 | 9.408; 10.125; 14.0952 90; 90; 90 | 1342.65 | Alberto Avenoza; Jesús H. Busto; Gonzalo Jiménez-Osés; Jesús M. Peregrina S~N~2 Reaction of Sulfur Nucleophiles with Hindered Sulfamidates: Enantioselective Synthesis of α-Methylisocysteine Journal of Organic Chemistry, 2006, 71, 1692-1695 |
4024730 | CIF | C10 H18 O2 | C 1 2 1 | 18.7017; 5.9044; 9.0335 90; 95.768; 90 | 992.45 | Olivier Corminboeuf; Larry E. Overman; Lewis D. Pennington A Unified Strategy for Enantioselective Total Synthesis of Cladiellin and Briarellin Diterpenes: Total Synthesis of Briarellins E and F and the Putative Structure of Alcyonin and Revision of Its Structure Assignment Journal of Organic Chemistry, 2009, 74, 5458-5470 |
4024731 | CIF | C10 H18 O2 | P 21 21 21 | 8.7131; 8.9587; 12.5043 90; 90; 90 | 976.1 | Olivier Corminboeuf; Larry E. Overman; Lewis D. Pennington A Unified Strategy for Enantioselective Total Synthesis of Cladiellin and Briarellin Diterpenes: Total Synthesis of Briarellins E and F and the Putative Structure of Alcyonin and Revision of Its Structure Assignment Journal of Organic Chemistry, 2009, 74, 5458-5470 |
4030414 | CIF | C10 H18 O2 | P 1 21/c 1 | 12.7135; 8.5955; 8.7809 90; 101.702; 90 | 939.62 | Olbrich, Martin; Mayer, Peter; Trauner, Dirk Synthetic Studies toward Polytwistane Hydrocarbon Nanorods. The Journal of organic chemistry, 2015, 80, 2042-2055 |
4020059 | CIF | C10 H18 O3 | P n a 21 | 17.2915; 10.6152; 5.8951 90; 90; 90 | 1082.06 | Guindon, Yvan; Brigitte Guérin; Cardinal-David, Benoit Structure of GUIN23 Journal of Organic Chemistry, 2005, 70, 776-784 |
4021048 | CIF | C10 H18 O3 | P 1 21/c 1 | 5.9658; 12.6612; 13.5514 90; 101.299; 90 | 1003.8 | David M. Hodgson; Frédéric Le Strat; Thomas D. Avery; Andrew C. Donohue; Tobias Brückl Stereocontrolled Syntheses of the Nemorensic Acids Using 6-Diazoheptane-2,5-dione in Carbonyl Ylide Cycloadditions Journal of Organic Chemistry, 2004, 69, 8796-8803 |
4026010 | CIF | C10 H18 O3 | P 1 21 1 | 8.003; 11.3185; 11.6939 90; 92.069; 90 | 1058.57 | Claudia J. Exner; Sylvain Laclef; Florent Poli; Maris Turks; Pierre Vogel Total Asymmetric Syntheses of β-Hydroxy-δ-lactones via Umpolung with Sulfur Dioxide Journal of Organic Chemistry, 2011, 76, 840-845 |
4024243 | CIF | C10 H18 O4 | P -1 | 8.6992; 9.7549; 13.8934 83.301; 86.487; 69.316 | 1095.21 | Jean-François Brazeau; Philippe Mochirian; Michel Prévost; Yvan Guindon Stereopentads Derived from a Sequence of Mukaiyama Aldolization and Free Radical Reduction on α-Methyl-β-alkoxy Aldehydes: A General Strategy for Efficient Polypropionate Synthesis Journal of Organic Chemistry, 2009, 74, 64-74 |
4027035 | CIF | C10 H18 O4 | P 21 21 21 | 6.6073; 10.3686; 15.9951 90; 90; 90 | 1095.8 | Ulf Scheffler; Rainer Mahrwald Histidine-Catalyzed Asymmetric Aldol Addition of Enolizable Aldehydes: Insights into its Mechanism Journal of Organic Chemistry, 2012, 77, 2310-2330 |
4025843 | CIF | C10 H18 O6 | P 1 21/c 1 | 5.8081; 10.9082; 8.2899 90; 91.556; 90 | 525.02 | Goverdhan Mehta; Saikat Sen A Vicarious One-Pot Transformation of a Fluorocyclitol to a Polycyclitol: Observation of a Formal 4-Fold Axial-Equatorial Epimerization on a Conformationally Locked Scaffold Journal of Organic Chemistry, 2010, 75, 8287-8290 |
4028063 | CIF | C10 H18 O7 | P 1 21/a 1 | 11.009; 9.033; 12.537 90; 105.775; 90 | 1199.78 | Himali Y. Godage; Andrew M. Riley; Timothy J. Woodman; Mark P. Thomas; Mary F. Mahon; Barry V. L. Potter Regioselective Opening of myo-Inositol Orthoesters: Mechanism and Synthetic Utility Journal of Organic Chemistry, 2013, 78, 2275-2288 |
4020156 | CIF | C10 H19 B F3 N | P b c a | 10.6045; 11.0631; 19.7482 90; 90; 90 | 2316.8 | Yun Ma; Emil Lobkovsky; David B. Collum Journal of Organic Chemistry, 2005, 70, 2335-2337 |
4023855 | CIF | C10 H19 B10 Cl | P 21 21 21 | 9.9573; 11.4293; 13.4628 90; 90; 90 | 1532.13 | Vincent Terrasson; José G. Planas; Damien Prim; Clara Viñas; Francesc Teixidor; Mark E. Light; Michael B. Hursthouse Cooperative Effect of Carborane and Pyridine in the Reaction of Carboranyl Alcohols with Thionyl Chloride: Halogenation versus Oxidation Journal of Organic Chemistry, 2008, 73, 9140-9143 |
4021722 | CIF | C10 H19 Br2 N O | P 1 21/c 1 | 15.0702; 9.4707; 17.8664 90; 91.564; 90 | 2549.04 | Matthias D'hooghe; Tim Vanlangendonck; Karl W. Törnroos; Norbert De Kimpe Novel Synthesis of cis-3,5-Disubstituted Morpholine Derivatives Journal of Organic Chemistry, 2006, 71, 4678-4681 |
4021494 | CIF | C10 H19 Cl O | I -4 | 16.4301; 16.4301; 8.272 90; 90; 90 | 2233.01 | R. Brandon Miles; Chad E. Davis; Robert M. Coates Syn- and Anti-Selective Prins Cyclizations of δ,ε-Unsaturated Ketones to 1,3-Halohydrins with Lewis Acids Journal of Organic Chemistry, 2006, 71, 1493-1501 |
4023126 | CIF | C10 H19 N O2 S | P 1 21/n 1 | 11.7827; 6.0089; 16.0233 90; 91.4596; 90 | 1134.1 | David M. Hodgson; Philip G. Humphreys; Steven M. Miles; Christopher A. J. Brierley; John G. Ward Dimerization and Isomerization Reactions of α-Lithiated Terminal Aziridines Journal of Organic Chemistry, 2007, 72, 10009-10021 |
4024576 | CIF | C10 H19 N2 O5 P | P 1 21/c 1 | 7.691; 10.311; 17.038 90; 96.56; 90 | 1342.3 | Nugzar Ghavtadze; Roland Fröhlich; Ernst-Ulrich Würthwein Acid-Mediated Electrocyclic Domino Transformations of 5,5-Disubstituted 1-Amino-1-azapenta-1,4-dien-3-ones into Dihydrospiroindenepyrazole and Dihydroindenodiazepine Derivatives Journal of Organic Chemistry, 2009, 74, 4584-4591 |
4036738 | CIF | C10 H2 Br2 Cl2 I2 N2 | P 21 21 21 | 7.779; 12.148; 16.057 90; 90; 90 | 1517.4 | Mamane, V.; Peluso, P.; Aubert, E.; Cossu, S.; Pale, P. Chiral Hexahalogenated 4,4'-Bipyridines. The Journal of organic chemistry, 2016, 81, 4576-4587 |
4036745 | CIF | C10 H2 Br2 Cl2 I2 N2 | P 21 21 21 | 8.034; 11.838; 16.278 90; 90; 90 | 1548.1 | Mamane, V.; Peluso, P.; Aubert, E.; Cossu, S.; Pale, P. Chiral Hexahalogenated 4,4'-Bipyridines. The Journal of organic chemistry, 2016, 81, 4576-4587 |
4036747 | CIF | C10 H2 Br2 Cl2 I2 N2 | P 21 21 21 | 7.913; 11.911; 15.781 90; 90; 90 | 1487.4 | Mamane, V.; Peluso, P.; Aubert, E.; Cossu, S.; Pale, P. Chiral Hexahalogenated 4,4'-Bipyridines. The Journal of organic chemistry, 2016, 81, 4576-4587 |
4036737 | CIF | C10 H2 Br2 I4 N2 | P 21 21 21 | 8.028; 11.128; 18.411 90; 90; 90 | 1644.8 | Mamane, V.; Peluso, P.; Aubert, E.; Cossu, S.; Pale, P. Chiral Hexahalogenated 4,4'-Bipyridines. The Journal of organic chemistry, 2016, 81, 4576-4587 |
4036739 | CIF | C10 H2 Br2 I4 N2 | P 21 21 21 | 7.985; 11.766; 17.716 90; 90; 90 | 1664.4 | Mamane, V.; Peluso, P.; Aubert, E.; Cossu, S.; Pale, P. Chiral Hexahalogenated 4,4'-Bipyridines. The Journal of organic chemistry, 2016, 81, 4576-4587 |
4036746 | CIF | C10 H2 Br2 I4 N2 | P 21 21 21 | 8.177; 12.152; 16.434 90; 90; 90 | 1633 | Mamane, V.; Peluso, P.; Aubert, E.; Cossu, S.; Pale, P. Chiral Hexahalogenated 4,4'-Bipyridines. The Journal of organic chemistry, 2016, 81, 4576-4587 |
4036744 | CIF | C10 H2 Br4 Cl2 N2 | P 21 21 21 | 7.659; 11.921; 15.999 90; 90; 90 | 1460.8 | Mamane, V.; Peluso, P.; Aubert, E.; Cossu, S.; Pale, P. Chiral Hexahalogenated 4,4'-Bipyridines. The Journal of organic chemistry, 2016, 81, 4576-4587 |
4036734 | CIF | C10 H2 Br4 I2 N2 | P 21 21 21 | 7.888; 12.138; 16.364 90; 90; 90 | 1566.8 | Mamane, V.; Peluso, P.; Aubert, E.; Cossu, S.; Pale, P. Chiral Hexahalogenated 4,4'-Bipyridines. The Journal of organic chemistry, 2016, 81, 4576-4587 |
4036735 | CIF | C10 H2 Br4 I2 N2 | P 21 21 21 | 7.8; 11.334; 18.031 90; 90; 90 | 1594 | Mamane, V.; Peluso, P.; Aubert, E.; Cossu, S.; Pale, P. Chiral Hexahalogenated 4,4'-Bipyridines. The Journal of organic chemistry, 2016, 81, 4576-4587 |
4036736 | CIF | C10 H2 Br4 I2 N2 | P 21 21 21 | 7.997; 11.722; 16.948 90; 90; 90 | 1588.7 | Mamane, V.; Peluso, P.; Aubert, E.; Cossu, S.; Pale, P. Chiral Hexahalogenated 4,4'-Bipyridines. The Journal of organic chemistry, 2016, 81, 4576-4587 |
4036742 | CIF | C10 H2 Br6 N2 | P 21 21 21 | 7.6444; 11.7708; 16.6604 90; 90; 90 | 1499.11 | Mamane, V.; Peluso, P.; Aubert, E.; Cossu, S.; Pale, P. Chiral Hexahalogenated 4,4'-Bipyridines. The Journal of organic chemistry, 2016, 81, 4576-4587 |
4036740 | CIF | C10 H2 Cl2 I4 N2 | P 21 21 21 | 7.957; 10.91; 18.607 90; 90; 90 | 1615.3 | Mamane, V.; Peluso, P.; Aubert, E.; Cossu, S.; Pale, P. Chiral Hexahalogenated 4,4'-Bipyridines. The Journal of organic chemistry, 2016, 81, 4576-4587 |
4036743 | CIF | C10 H2 Cl2 I4 N2 | P 21 21 21 | 7.906; 11.78; 17.605 90; 90; 90 | 1639.6 | Mamane, V.; Peluso, P.; Aubert, E.; Cossu, S.; Pale, P. Chiral Hexahalogenated 4,4'-Bipyridines. The Journal of organic chemistry, 2016, 81, 4576-4587 |
4036741 | CIF | C10 H2 I6 N2 | P 21 21 21 | 8.219; 11.493; 18.059 90; 90; 90 | 1705.9 | Mamane, V.; Peluso, P.; Aubert, E.; Cossu, S.; Pale, P. Chiral Hexahalogenated 4,4'-Bipyridines. The Journal of organic chemistry, 2016, 81, 4576-4587 |
4023853 | CIF | C10 H20 B10 O | P -1 | 10.9455; 12.2976; 12.485 102.934; 104.718; 101.336 | 1525.82 | Vincent Terrasson; José G. Planas; Damien Prim; Clara Viñas; Francesc Teixidor; Mark E. Light; Michael B. Hursthouse Cooperative Effect of Carborane and Pyridine in the Reaction of Carboranyl Alcohols with Thionyl Chloride: Halogenation versus Oxidation Journal of Organic Chemistry, 2008, 73, 9140-9143 |
4022570 | CIF | C10 H20 Cl N | P c c n | 20.349; 14.534; 7.515 90; 90; 90 | 2222.7 | Gary A. Molander; Shawn K. Pack Determining the Scope of the Organolanthanide-Catalyzed, Sequential Intramolecular Amination/Cyclization Reaction: Formation of Substituted Quinolizidines, Indolizidines, and Pyrrolizidines Journal of Organic Chemistry, 2003, 68, 9214-9220 |
4028400 | CIF | C10 H20 N O4 S | P 1 21/c 1 | 12.9484; 9.9797; 11.131 90; 113.437; 90 | 1319.69 | Miroslav Kavala; Roman Boča; Lubomír Dlháň; Vlasta Brezová; Martin Breza; Jozef Kožíšek; Marek Fronc; Peter Herich; Lubomír Švorc; Peter Szolcsányi Preparation and Spectroscopic, Magnetic, and Electrochemical Studies of Mono-/Biradical TEMPO Derivatives Journal of Organic Chemistry, 2013, 78, 6558-6569 |
4024842 | CIF | C10 H20 O2 | P 1 21 1 | 9.245; 6.063; 10.2457 90; 115.422; 90 | 518.69 | Laura E. Bourque; Pamela A. Haile; K. A. Woerpel Silylene-Mediated Ring Contraction of Homoallylic Ethers To Form Allylic Silanes Journal of Organic Chemistry, 2009, 74, 7180-7182 |
4024233 | CIF | C10 H20 O4 | P -1 | 9.3219; 10.5827; 11.9459 83.63; 68.448; 73.18 | 1049.2 | Peter Valente; Thomas D. Avery; Dennis K. Taylor; Edward R. T. Tiekink Synthesis and Chemistry of 2,3-Dioxabicyclo[2.2.2]octane-5,6-diols Journal of Organic Chemistry, 2009, 74, 274-282 |
4024234 | CIF | C10 H20 O4 | P 1 21 1 | 6.6; 9.507; 17.683 90; 93.003; 90 | 1108 | Peter Valente; Thomas D. Avery; Dennis K. Taylor; Edward R. T. Tiekink Synthesis and Chemistry of 2,3-Dioxabicyclo[2.2.2]octane-5,6-diols Journal of Organic Chemistry, 2009, 74, 274-282 |
4028401 | CIF | C10 H21 N2 O3 S | P 1 21/c 1 | 6.3108; 21.6752; 11.2066 90; 119.167; 90 | 1338.56 | Miroslav Kavala; Roman Boča; Lubomír Dlháň; Vlasta Brezová; Martin Breza; Jozef Kožíšek; Marek Fronc; Peter Herich; Lubomír Švorc; Peter Szolcsányi Preparation and Spectroscopic, Magnetic, and Electrochemical Studies of Mono-/Biradical TEMPO Derivatives Journal of Organic Chemistry, 2013, 78, 6558-6569 |
4033827 | CIF | C10 H22 Cl2 Cu N2 O8 S2 | P n m a | 14.0671; 9.6321; 13.0463 90; 90; 90 | 1767.7 | Taschner, Ian S.; Walker, Tia L.; DeHaan, Hunter S.; Schrage, Briana R.; Ziegler, Christopher J.; Taschner, Michael J. Synthesis, Characterization, and Copper(II) Chelates of 1,11-Dithia-4,8-diazacyclotetradecane. The Journal of organic chemistry, 2019, 84, 11091-11102 |
4021721 | CIF | C10 H22 N2 O2 Os | P b c n | 6.1505; 12.5027; 16.6071 90; 90; 90 | 1277.05 | Timothy J. Donohoe; Robert M. Harris; Sam Butterworth; Jeremy N. Burrows; Andrew Cowley; Jeremy S. Parker New Osmium-Based Reagent for the Dihydroxylation of Alkenes Journal of Organic Chemistry, 2006, 71, 4481-4489 |
4021953 | CIF | C10 H22 O4 | P 1 21/c 1 | 8.547; 6.899; 9.743 90; 101.65; 90 | 562.7 | Tony V. Robinson; Dennis K. Taylor; Edward R. T. Tiekink Osmium Catalyzed Dihydroxylation of 1,2-Dioxines: A New Entry for Stereoselective Sugar Synthesis Journal of Organic Chemistry, 2006, 71, 7236-7244 |
4027044 | CIF | C10 H23 N O3 Si2 | P 1 21/c 1 | 6.0574; 11.2877; 21.5246 90; 105.601; 90 | 1417.5 | Nataliya F. Lazareva; Bagrat A. Shainyan; Uwe Schilde; Nina N. Chipanina; Larisa P. Oznobikhina; Alexander I. Albanov; Erich Kleinpeter Synthesis, Molecular Structure, Conformational Analysis, and Chemical Properties of Silicon-Containing Derivatives of Quinolizidine Journal of Organic Chemistry, 2012, 77, 2382-2388 |
4033824 | CIF | C10 H24 Cl2 N2 S2 | P b c a | 8.8079; 10.9869; 31.112 90; 90; 90 | 3010.8 | Taschner, Ian S.; Walker, Tia L.; DeHaan, Hunter S.; Schrage, Briana R.; Ziegler, Christopher J.; Taschner, Michael J. Synthesis, Characterization, and Copper(II) Chelates of 1,11-Dithia-4,8-diazacyclotetradecane. The Journal of organic chemistry, 2019, 84, 11091-11102 |
4028475 | CIF | C10 H3 Br Cl2 I2 N2 | C 1 2 1 | 26.6463; 8.8622; 13.5771 90; 119.908; 90 | 2779.19 | Victor Mamane; Emmanuel Aubert; Paola Peluso; Sergio Cossu Lithiation of Prochiral 2,2'-Dichloro-5,5'-dibromo-4,4'-bipyridine as a Tool for the Synthesis of Chiral Polyhalogenated 4,4'-Bipyridines Journal of Organic Chemistry, 2013, 78, 7683-7689 |
4028474 | CIF | C10 H3 Br2 Cl2 I N2 | P 1 | 6.8899; 9.0638; 11.7741 90.773; 101.424; 111.34 | 668.341 | Victor Mamane; Emmanuel Aubert; Paola Peluso; Sergio Cossu Lithiation of Prochiral 2,2'-Dichloro-5,5'-dibromo-4,4'-bipyridine as a Tool for the Synthesis of Chiral Polyhalogenated 4,4'-Bipyridines Journal of Organic Chemistry, 2013, 78, 7683-7689 |
4025410 | CIF | C10 H4 Br2 Cl2 N2 | P c c n | 8.4513; 11.8642; 11.7832 90; 90; 90 | 1181.48 | Mohamed Abboud; Victor Mamane; Emmanuel Aubert; Claude Lecomte; Yves Fort Synthesis of Polyhalogenated 4,4'-Bipyridines via a Simple Dimerization Procedure Journal of Organic Chemistry, 2010, 75, 3224-3231 |
4037603 | CIF | C10 H4 Br2 I2 N2 | P 1 | 8.078; 11.2993; 15.5039 102.689; 98.153; 90.893 | 1365.01 | Mamane, Victor; Aubert, Emmanuel; Peluso, Paola; Cossu, Sergio Synthesis, resolution, and absolute configuration of chiral 4,4'-bipyridines. The Journal of organic chemistry, 2012, 77, 2579-2583 |
4025412 | CIF | C10 H4 Br4 N2 | P -1 | 7.43736; 7.9517; 11.0587 96.1554; 105.829; 96.035 | 619.38 | Mohamed Abboud; Victor Mamane; Emmanuel Aubert; Claude Lecomte; Yves Fort Synthesis of Polyhalogenated 4,4'-Bipyridines via a Simple Dimerization Procedure Journal of Organic Chemistry, 2010, 75, 3224-3231 |
4025413 | CIF | C10 H4 Br4 N2 | C 1 c 1 | 8.111; 20.3758; 8.2664 90; 117.055; 90 | 1216.67 | Mohamed Abboud; Victor Mamane; Emmanuel Aubert; Claude Lecomte; Yves Fort Synthesis of Polyhalogenated 4,4'-Bipyridines via a Simple Dimerization Procedure Journal of Organic Chemistry, 2010, 75, 3224-3231 |
4026678 | CIF | C10 H4 Cl4 N2 O2 | C 1 2/c 1 | 17.767; 4.3191; 17.551 90; 117.518; 90 | 1194.4 | Brian C. Tlach; Aimée L. Tomlinson; Achala Bhuwalka; Malika Jeffries-EL Tuning the Optical and Electronic Properties of 4,8-Disubstituted Benzobisoxazoles via Alkyne Substitution Journal of Organic Chemistry, 2011, 76, 8670-8681 |
4028546 | CIF | C10 H4 F4 N8 | P 21 21 2 | 12.571; 20.299; 4.706 90; 90; 90 | 1200.9 | Michael De Rosa; David Arnold; Douglas Hartline Four Mechanisms in the Reactions of 3-Aminopyrrole with 1,3,5-Triazines: Inverse Electron Demand Diels-Alder Cycloadditions vs SNAr Reactions via Uncatalyzed and Acid-Catalyzed Pathways Journal of Organic Chemistry, 2013, 78, 8614-8623 |
4024033 | CIF | C10 H4 F5 N3 O2 | C 1 2/c 1 | 21.669; 8.3096; 12.758 90; 113.409; 90 | 2108.1 | Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport Enols of Substituted Cyanomalonamides Journal of Organic Chemistry, 2007, 72, 5297-5312 |
4038947 | CIF | C10 H4 N4 S2 | P 1 21/c 1 | 7.8092; 17.4192; 6.8514 90; 95.335; 90 | 927.96 | Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Molecular Organization of 2,1,3-Benzothiadiazoles in the Solid State. The Journal of organic chemistry, 2017, 82, 5034-5045 |
4025411 | CIF | C10 H5 Br Cl2 N2 | P 1 21 1 | 7.3807; 7.2933; 10.2971 90; 107.738; 90 | 527.94 | Mohamed Abboud; Victor Mamane; Emmanuel Aubert; Claude Lecomte; Yves Fort Synthesis of Polyhalogenated 4,4'-Bipyridines via a Simple Dimerization Procedure Journal of Organic Chemistry, 2010, 75, 3224-3231 |
4025414 | CIF | C10 H5 Br Cl2 N2 | P n a 21 | 13.6345; 3.8144; 19.833 90; 90; 90 | 1031.46 | Mohamed Abboud; Victor Mamane; Emmanuel Aubert; Claude Lecomte; Yves Fort Synthesis of Polyhalogenated 4,4'-Bipyridines via a Simple Dimerization Procedure Journal of Organic Chemistry, 2010, 75, 3224-3231 |
4036895 | CIF | C10 H5 Br F6 O3 S | P -1 | 7.8097; 8.4203; 10.7272 98.112; 95.627; 98.351 | 685.88 | Zhao, Yilong; Zhou, Yuhan; Liu, Juan; Yang, Dongmei; Tao, Liang; Liu, Yang; Dong, Xiaoliang; Liu, Jianhui; Qu, Jingping Synthesis of (Z)-α-Trifluoromethyl Alkenyl Triflate: A Scaffold for Diverse Trifluoromethylated Species. The Journal of organic chemistry, 2016, 81, 4797-4806 |
4032479 | CIF | C10 H5 Cl F5 N5 | P 1 21/c 1 | 18.65; 5.121; 14.299 90; 112.07; 90 | 1265.6 | Centore, Roberto; Manfredi, Carla; Capobianco, Amedeo; Volino, Sabato; Ferrara, Maria Vittoria; Carella, Antonio; Fusco, Sandra; Peluso, Andrea Solid State Separation and Isolation of Tautomers of Fused-Ring Triazolotriazoles. The Journal of organic chemistry, 2017 |
4038249 | CIF | C10 H5 Cl N2 O2 | P -1 | 6.667; 6.7899; 11.05 81.39; 86.15; 75.78 | 479.18 | Matsubara, Ryosuke; Ando, Akihiro; Hasebe, Hayu; Kim, Hojin; Tsuneda, Takao; Hayashi, Masahiko Synthesis and Synthetic Application of Chloro- and Bromofuroxans. The Journal of organic chemistry, 2020, 85, 5959-5972 |
4032995 | CIF | C10 H5 Cl3 N2 O | P 1 21/c 1 | 8.0101; 19.8721; 7.4121 90; 111.141; 90 | 1100.43 | Takahashi, Yuka; Ikeda, Hirotaka; Kanase, Yuki; Makino, Kosho; Tabata, Hidetsugu; Oshitari, Tetsuta; Inagaki, Satoshi; Otani, Yuko; Natsugari, Hideaki; Takahashi, Hideyo; Ohwada, Tomohiko Elucidation of the E-Amide Preference of N-Acyl Azoles. The Journal of organic chemistry, 2017, 82, 11370-11382 |
4020354 | CIF | C10 H5 N3 O2 | P n m a | 17.447; 6.625; 7.767 90; 90; 90 | 897.8 | Jordan R. Quinn; Steven C. Zimmerman Structure-Function Studies on a Synthetic Guanosine Receptor That Simultaneously Binds Watson-Crick and Hoogsteen Sites Journal of Organic Chemistry, 2005, 70, 7459-7467 |
4034454 | CIF | C10 H5 N5 | P 1 21/c 1 | 7.1948; 13.3348; 9.1745 90; 107.609; 90 | 838.97 | Ghosh, Sanjib; Roy, Biswajit; Bandyopadhyay, Subhajit Formation or Cleavage of Rings via Sulfide-Mediated Reduction Offers Background-Free Detection of Sulfide. The Journal of organic chemistry, 2019, 84, 12031-12039 |
4024247 | CIF | C10 H6 Br N O2 | P -1 | 7.203; 7.444; 9.295 82.759; 73.703; 89.824 | 474.28 | Asbjørn S. Andersson; Lasse Kerndrup; Anders Ø. Madsen; Kristine Kilså; Mogens Brøndsted Nielsen; Philip R. La Porta; Ivan Biaggio Synthesis and Characterization of Tetrathiafulvalene-Substituted Di- and Tetraethynylethenes with p-Nitrophenyl Acceptors Journal of Organic Chemistry, 2009, 74, 375-382 |
4025380 | CIF | C10 H6 Br N O2 S | P n a 21 | 26.215; 3.8912; 9.856 90; 90; 90 | 1005.4 | Cornelius J. O; Connor'; Mark D. Roydhouse; Anna M. Przybył; Michael D. Wall; J. Mike Southern Facile Synthesis of 3-Nitro-2-substituted Thiophenes Journal of Organic Chemistry, 2010, 75, 2534-2538 |
4037764 | CIF | C10 H6 Br N3 S | P -1 | 6.7411; 8.5273; 9.4191 83.71; 88.23; 76.21 | 522.7 | Sun, Kai; Li, Yali; Feng, Ranran; Mu, Shiqiang; Wang, Xin; Zhang, Bing C-H Imidation and Dual C-H Bond Aminobromination of Five-Membered Heterocycles. The Journal of organic chemistry, 2019 |
4026676 | CIF | C10 H6 Cl2 N2 O2 | P 1 21/n 1 | 7.458; 4.364; 15.876 90; 92.02; 90 | 516.4 | Brian C. Tlach; Aimée L. Tomlinson; Achala Bhuwalka; Malika Jeffries-EL Tuning the Optical and Electronic Properties of 4,8-Disubstituted Benzobisoxazoles via Alkyne Substitution Journal of Organic Chemistry, 2011, 76, 8670-8681 |
4038253 | CIF | C10 H6 Cl2 N2 O2 | P -1 | 5.5643; 9.865; 10.798 112.164; 95.909; 103.111 | 522.8 | Matsubara, Ryosuke; Ando, Akihiro; Hasebe, Hayu; Kim, Hojin; Tsuneda, Takao; Hayashi, Masahiko Synthesis and Synthetic Application of Chloro- and Bromofuroxans. The Journal of organic chemistry, 2020, 85, 5959-5972 |
4025175 | CIF | C10 H6 Cl2 N2 S2 | P -1 | 6.3376; 7.334; 12.454 93.007; 100.106; 99.647 | 559.8 | Jared F. Mike; Jeremy J. Inteman; Arkady Ellern; Malika Jeffries-EL Facile Synthesis of 2,6-Disubstituted Benzobisthiazoles: Functional Monomers for the Design of Organic Semiconductors Journal of Organic Chemistry, 2010, 75, 495-497 |
4020625 | CIF | C10 H6 Cl3 N O2 S | P -1 | 5.6712; 8.6976; 12.308 96.964; 90.165; 90.255 | 602.61 | Sonia Macho; Daniel Miguel; Teresa Gómez; Teresa Rodríguez; Tomás Torroba From Cyclopentanone Oximes to Bis[1,2,3]dithiazolo-s-indacenes, Cyclopenta[c][1,2]thiazine, Pentathiepino-, Tetrathiino-, and Thienocyclopenta[1,2,3]dithiazoles as a Rich Source of New Materials Journal of Organic Chemistry, 2005, 70, 9314-9325 |
4032805 | CIF | C10 H6 F3 N3 O2 | P 1 21/c 1 | 7.8683; 11.5556; 11.5585 90; 96.3412; 90 | 1044.5 | Huang, Adrian; Wo, Kellie; Lee, So Yeun Christine; Kneitschel, Nika; Chang, Jennifer; Zhu, Kathleen; Mello, Tatsiana; Bancroft, Laura; Norman, Natalie J.; Zheng, Shao-Liang Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles. The Journal of organic chemistry, 2017, 82, 8864-8872 |
4025265 | CIF | C10 H6 N2 S3 | P 1 21 1 | 3.8595; 10.702; 12.76 90; 98.03; 90 | 521.88 | Jean-Yves Balandier; Marcos Chas; Paul I. Dron; Sébastien Goeb; David Canevet; Ahmed Belyasmine; Magali Allain; Marc Sallé N-Aryl Pyrrolo-tetrathiafulvalene Based Ligands: Synthesis and Metal Coordination Journal of Organic Chemistry, 2010, 75, 1589-1599 |
4032793 | CIF | C10 H6 N4 O2 | P 1 21/n 1 | 3.7941; 13.5676; 18.5776 90; 90.69; 90 | 956.25 | Huang, Adrian; Wo, Kellie; Lee, So Yeun Christine; Kneitschel, Nika; Chang, Jennifer; Zhu, Kathleen; Mello, Tatsiana; Bancroft, Laura; Norman, Natalie J.; Zheng, Shao-Liang Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles. The Journal of organic chemistry, 2017, 82, 8864-8872 |
4032794 | CIF | C10 H6 N4 O2 | P 1 21/c 1 | 11.9915; 14.3694; 11.2447 90; 102.04; 90 | 1894.96 | Huang, Adrian; Wo, Kellie; Lee, So Yeun Christine; Kneitschel, Nika; Chang, Jennifer; Zhu, Kathleen; Mello, Tatsiana; Bancroft, Laura; Norman, Natalie J.; Zheng, Shao-Liang Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles. The Journal of organic chemistry, 2017, 82, 8864-8872 |
4020751 | CIF | C10 H6 S2 | P -1 | 5.842; 7.803; 9.58 98.06; 100.15; 91.75 | 425 | Kazuo Takimiya; Yasushi Konda; Hideaki Ebata; Naoto Niihara; Tetsuo Otsubo Facile Synthesis, Structure, and Properties of Benzo[1,2-b:4,5-b']dichalcogenophenes Journal of Organic Chemistry, 2005, 70, 10569-10571 |
4020752 | CIF | C10 H6 Se2 | P -1 | 5.7985; 7.9434; 9.864 97.41; 101.48; 91.567 | 440.87 | Kazuo Takimiya; Yasushi Konda; Hideaki Ebata; Naoto Niihara; Tetsuo Otsubo Facile Synthesis, Structure, and Properties of Benzo[1,2-b:4,5-b']dichalcogenophenes Journal of Organic Chemistry, 2005, 70, 10569-10571 |
4020753 | CIF | C10 H6 Te2 | P -1 | 5.822; 8.122; 10.292 95.85; 102.59; 91.3 | 472 | Kazuo Takimiya; Yasushi Konda; Hideaki Ebata; Naoto Niihara; Tetsuo Otsubo Facile Synthesis, Structure, and Properties of Benzo[1,2-b:4,5-b']dichalcogenophenes Journal of Organic Chemistry, 2005, 70, 10569-10571 |
4020200 | CIF | C10 H7 Br N2 O2 | P 1 21/n 1 | 11.5904; 5.7419; 16.1679 90; 106.644; 90 | 1030.91 | N. R. Conley; R. J. Hung; C. G. Willson Journal of Organic Chemistry, 2005, 70, 4553-4555 |
4020201 | CIF | C10 H7 Br N2 O2 | P -1 | 5.9611; 7.5339; 11.4495 76.697; 77.861; 85.168 | 488.87 | N. R. Conley; R. J. Hung; C. G. Willson Journal of Organic Chemistry, 2005, 70, 4553-4555 |
4028220 | CIF | C10 H7 Br N2 O2 | P 1 21/n 1 | 10.882; 7.6896; 11.7402 90; 105.997; 90 | 944.36 | Fabrício F. Naciuk; Julio C. Milan; Almir Andreão; Paulo C. M. L. Miranda Exploitation of a Tuned Oxidation with N-Haloimides in the Synthesis of Caulibugulones A-D Journal of Organic Chemistry, 2013, 78, 5026-5030 |
4031036 | CIF | C10 H7 Br O S | P 1 21/n 1 | 4.0495; 5.6747; 41.897 90; 91.009; 90 | 962.6 | Mal, Kanchan; Kaur, Amanpreet; Haque, Fazle; Das, Indrajit PPh3·HBr-DMSO: A Reagent System for Diverse Chemoselective Transformations. The Journal of organic chemistry, 2015, 80, 6400-6410 |
4038887 | CIF | C10 H7 Br2 F O2 S | P 1 21/n 1 | 7.12; 7.8736; 21.6656 90; 93.465; 90 | 1212.35 | Zhang, Zai-Wei; Wang, Shi-Meng; Fang, Wan-Yin; Lekkala, Ravindar; Qin, Hua-Li A protocol for stereoselective construction of highly functionalized dienyl sulfonyl fluoride warheads. The Journal of organic chemistry, 2020 |
4022761 | CIF | C10 H7 Br2 N3 O3 | P 1 21/c 1 | 7.3962; 24.731; 6.9611 90; 111.789; 90 | 1182.3 | Kathryn M. Evans; Alexandra M. Z. Slawin; Tomas Lebl; Douglas Philp; Nicholas J. Westwood An Improved Understanding of the Reaction of Bis(bromomethyl)quinoxaline 1-N-Oxides with Amines Using Substituent Effects Journal of Organic Chemistry, 2007, 72, 3186-3193 |
4022764 | CIF | C10 H7 Br2 N3 O3 | P -1 | 7.314; 7.7055; 11.226 87.946; 89.412; 72.355 | 602.5 | Kathryn M. Evans; Alexandra M. Z. Slawin; Tomas Lebl; Douglas Philp; Nicholas J. Westwood An Improved Understanding of the Reaction of Bis(bromomethyl)quinoxaline 1-N-Oxides with Amines Using Substituent Effects Journal of Organic Chemistry, 2007, 72, 3186-3193 |
4022762 | CIF | C10 H7 Br3 N2 O | P -1 | 7.483; 7.6916; 10.345 100.412; 93.102; 95.459 | 581.4 | Kathryn M. Evans; Alexandra M. Z. Slawin; Tomas Lebl; Douglas Philp; Nicholas J. Westwood An Improved Understanding of the Reaction of Bis(bromomethyl)quinoxaline 1-N-Oxides with Amines Using Substituent Effects Journal of Organic Chemistry, 2007, 72, 3186-3193 |
4022763 | CIF | C10 H7 Br3 N2 O | P -1 | 7.4673; 7.8862; 10.833 86.162; 88.275; 65.97 | 581.4 | Kathryn M. Evans; Alexandra M. Z. Slawin; Tomas Lebl; Douglas Philp; Nicholas J. Westwood An Improved Understanding of the Reaction of Bis(bromomethyl)quinoxaline 1-N-Oxides with Amines Using Substituent Effects Journal of Organic Chemistry, 2007, 72, 3186-3193 |
4028221 | CIF | C10 H7 Cl N2 O2 | P 1 21 1 | 5.3738; 5.4329; 16.3535 90; 95.509; 90 | 475.24 | Fabrício F. Naciuk; Julio C. Milan; Almir Andreão; Paulo C. M. L. Miranda Exploitation of a Tuned Oxidation with N-Haloimides in the Synthesis of Caulibugulones A-D Journal of Organic Chemistry, 2013, 78, 5026-5030 |
4022004 | CIF | C10 H7 F6 I O | P 1 21/c 1 | 11.4023; 12.5114; 17.0335 90; 101.099; 90 | 2384.52 | Darko Dolenc; Božo Plesničar Abstraction of Iodine from Aromatic Iodides by Alkyl Radicals: Steric and Electronic Effects Journal of Organic Chemistry, 2006, 71, 8028-8036 |
4033599 | CIF | C10 H7 N3 | C 1 2/c 1 | 9.5514; 9.5468; 17.8087 90; 105.517; 90 | 1564.7 | Simeth, Nadja A.; Bellisario, Alfredo; Crespi, Stefano; Fagnoni, Maurizio; König, Burkhard Substituent Effects on 3-Arylazoindole Photoswitches. The Journal of organic chemistry, 2019, 84, 6565-6575 |
4034456 | CIF | C10 H7 N3 | P -1 | 6.7285; 6.8933; 9.436 96.507; 104.492; 98.12 | 414.41 | Ghosh, Sanjib; Roy, Biswajit; Bandyopadhyay, Subhajit Formation or Cleavage of Rings via Sulfide-Mediated Reduction Offers Background-Free Detection of Sulfide. The Journal of organic chemistry, 2019, 84, 12031-12039 |
4035586 | CIF | C10 H7 N3 O | P 21 21 21 | 5.0522; 8.4389; 21.7226 90; 90; 90 | 926.14 | Sakharov, Pavel A.; Novikov, Mikhail S.; Khlebnikov, Alexander F. 2-Diazoacetyl-2 H-azirines: Source of a Variety of 2 H-Azirine Building Blocks with Orthogonal and Domino Reactivity. The Journal of organic chemistry, 2018, 83, 8304-8314 |
4027274 | CIF | C10 H7 N3 O S2 | P 1 21/c 1 | 13.321; 7.8902; 11.259 90; 92.32; 90 | 1182.4 | Kalen N. Swanick; Jacquelyn T. Price; Nathan D. Jones; Zhifeng Ding Synthesis, Structure, Electrochemistry, and Electrochemiluminescence of Thienyltriazoles Journal of Organic Chemistry, 2012, 77, 5646-5655 |
4023263 | CIF | C10 H7 N3 S2 | P 1 21/c 1 | 4.3559; 17.3837; 13.9844 90; 95.585; 90 | 1053.9 | Ahmad Basheer; Zvi Rappoport A Rich Array of Reactions of Cyanomonothiocarbonylmalonamides RNHCSCH(CN)CONHR' and Their Thioenols RNHC(SH)=C(CN)CONHR' Journal of Organic Chemistry, 2008, 73, 1386-1396 |
4020277 | CIF | C10 H8 Ag F3 O2 Se4 | P 1 21/c 1 | 12.61; 8.781; 13.849 90; 89.86; 90 | 1533 | Toshio Shimizu; Mari Kawaguchi; Takahiro Tsuchiya; Kazunori Hirabayashi; Nobumasa Kamigata Journal of Organic Chemistry, 2005, 70, 5036-5044 |
4020279 | CIF | C10 H8 Ag F3 O2 Se4 | P -1 | 9.988; 10.253; 9.82 117.67; 115.71; 64.52 | 768.7 | Toshio Shimizu; Mari Kawaguchi; Takahiro Tsuchiya; Kazunori Hirabayashi; Nobumasa Kamigata Journal of Organic Chemistry, 2005, 70, 5036-5044 |
4023705 | CIF | C10 H8 B0.5 Cu0.5 F2 N2 | C 2 2 21 | 10.937; 20.414; 9.167 90; 90; 90 | 2046.7 | Jiajia Niu; Hua Zhou; Zhigang Li; Jingwei Xu; Shaojing Hu An Efficient Ullmann-Type C-O Bond Formation Catalyzed by an Air-Stable Copper(I)-Bipyridyl Complex Journal of Organic Chemistry, 2008, 73, 7814-7817 |
4028812 | CIF | C10 H8 Br N O2 | P 1 21/c 1 | 9.856; 13.199; 7.922 90; 109.051; 90 | 974.1 | Ram N. Ram; Vineet Kumar Soni Synthesis of 3-Alkylbenzoxazolones from N-Alkyl-N-arylhydroxylamines by Contiguous O-Trichloroacetylation, Trichloroacetoxy ortho-Shift, and Cyclization Sequence Journal of Organic Chemistry, 2013, 78, 11935-11947 |
4022652 | CIF | C10 H8 Br N O3 | P 1 21 1 | 7.1454; 6.9176; 10.0029 90; 98.292; 90 | 489.265 | Aitor Landa; Bo Richter; Rasmus Lyng Johansen; Anna Minkkilä; Karl Anker Jørgensen Bisoxazoline-Lewis Acid-Catalyzed Direct-Electron Demand oxo-Hetero-Diels-Alder Reactions of N-Oxy-pyridine Aldehyde and Ketone Derivatives Journal of Organic Chemistry, 2007, 72, 240-245 |
4020283 | CIF | C10 H8 Br2 N2 | C 1 2/c 1 | 23.882; 6.7351; 13.747 90; 110.39; 90 | 2072.5 | Russell J. Pearson; Kathryn M. Evans; Alexandra M. Z. Slawin; Douglas Philp; Nicholas J. Westwood Journal of Organic Chemistry, 2005, 70, 5055-5061 |
4020284 | CIF | C10 H8 Br2 N2 O | P -1 | 7.2876; 7.3084; 10.801 81.55; 88.035; 66.12 | 520.11 | Russell J. Pearson; Kathryn M. Evans; Alexandra M. Z. Slawin; Douglas Philp; Nicholas J. Westwood Journal of Organic Chemistry, 2005, 70, 5055-5061 |
4020783 | CIF | C10 H8 Br2 O2 | P 1 21/c 1 | 11.7974; 8.1389; 11.4455 90; 98.719; 90 | 1086.27 | Ravi S. Orugunty; Dennis L. Wright; Merle A. Battiste; Richard J. Helmich; Khalil Abboud Bicyclo[3.2.1]octane Synthons from Cyclopropenes: Functionalization of Cycloadducts by Nucleophilic Additions Journal of Organic Chemistry, 2004, 69, 406-416 |
4034036 | CIF | C10 H8 Cl F2 N O2 | P 1 21/c 1 | 11.454; 9.9349; 9.8667 90; 98.818; 90 | 1109.5 | Tang, Lin; Yang, Zhen; Jiao, Jingchao; Cui, Ying; Zou, Guodong; Zhou, Qiuju; Zhou, Yuqiang; Rao, Weihao; Ma, Xiantao Chemoselective Mono- and Difluorination of 1,3-Dicarbonyl Compounds. The Journal of organic chemistry, 2019, 84, 10449-10458 |
4035157 | CIF | C10 H8 Cl2 N2 O6 | P 21 21 21 | 5.194; 10.453; 23.0032 90; 90; 90 | 1248.91 | Cleveland, Alexander H.; Fronczek, Frank R.; Kartika, Rendy Synthesis of Vicinal Dichlorides via Activation of Aliphatic Terminal Epoxides with Triphosgene and Pyridine. The Journal of organic chemistry, 2018, 83, 3367-3377 |
4022027 | CIF | C10 H8 Cl3 N2 O P | P b c a | 12.028; 12.923; 16.482 90; 90; 90 | 2561.8 | Anatoliy P. Marchenko; Georgyi N. Koidan; Aleksandr N. Kostyuk; Andrei A. Tolmachev; Evgenij G. Kapustin; Aleksandr M. Pinchuk A Representative of P,P,P-Trihalogenylides: Synthesis and Structure Journal of Organic Chemistry, 2006, 71, 8633-8636 |
4020793 | CIF | C10 H8 F N O5 S | P 1 21/n 1 | 10.085; 20.08; 5.43 90; 90.23; 90 | 1099.6 | Katsutoshi Suzuki; Toshio Fuchigami Electrolytic Partial Fluorination of Organic Compounds. 71. Highly Diastereoselective Anodic Fluorination of Sulfides Having Oxygen-Containing Heterocyclic Groups Journal of Organic Chemistry, 2004, 69, 1276-1282 |
4022032 | CIF | C10 H8 F2 O2 | P 1 21/c 1 | 17.51; 5.662; 9.238 90; 90.25; 90 | 915.9 | Wadih Ghattas; Corinna R. Hess; Gilles Iacazio; Renaud Hardré; Judith P. Klinman; Marius Réglier Pathway for the Stereocontrolled Z and E Production of α,α-Difluorine-Substituted Phenyl Butenoates Journal of Organic Chemistry, 2006, 71, 8618-8621 |
4022033 | CIF | C10 H8 F2 O2 | P 1 21/c 1 | 18.045; 5.4411; 9.4675 90; 93.781; 90 | 927.47 | Wadih Ghattas; Corinna R. Hess; Gilles Iacazio; Renaud Hardré; Judith P. Klinman; Marius Réglier Pathway for the Stereocontrolled Z and E Production of α,α-Difluorine-Substituted Phenyl Butenoates Journal of Organic Chemistry, 2006, 71, 8618-8621 |
4033322 | CIF | C10 H8 F3 I N2 O2 | P 1 21/c 1 | 8.741; 5.5915; 25.644 90; 95.471; 90 | 1247.65 | Wang, Yuxiang; Wang, Ke-Hu; Su, Yingpeng; Yang, Zheng; Wen, Lan; Liu, Lili; Wang, Juanjuan; Huang, Danfeng; Hu, Yulai Cascade Oxidation/Halogenoaminocyclization Reaction of Trifluoromethylated Homoallylic N-Acylhydrazines: Metal-free Synthesis of CF<sub>3</sub>-Substituted Pyrazolines. The Journal of organic chemistry, 2018, 83, 939-950 |
4023043 | CIF | C10 H8 F3 N O | P -1 | 6.5694; 7.825; 9.863 76.478; 78.156; 82.191 | 480.4 | Zengxue Wang; Wen Wan; Haizhen Jiang; Jian Hao One-Pot Cyclization of 2-Aminophenethyl Alcohols: A Novel and Direct Approach to the Synthesis of N-Acyl Indolines Journal of Organic Chemistry, 2007, 72, 9364-9367 |
4022189 | CIF | C10 H8 F9 N O4 S | P 1 21/c 1 | 15.1567; 5.702; 17.05 90; 101.526; 90 | 1443.81 | Ahmad Basheer; Zvi Rappoport Substituted 2-Methylene-1,3-oxazolidines, -1,3-thiazolidines, -1,3-benzothiazines, -1,3-oxazines, and Substituted Imidazopyrimidinediones from Cl(CH~2~)~n~NCO and Cl(CH~2~)~n~NCS and Active Methylene Compound Journal of Organic Chemistry, 2006, 71, 9743-9750 |
4025244 | CIF | C10 H8 N2 O | P 1 21/n 1 | 9.5287; 17.6893; 9.7101 90; 91.9406; 90 | 1635.76 | Michael Krayer; Marcin Ptaszek; Han-Je Kim; Kelly R. Meneely; Dazhong Fan; Kristen Secor; Jonathan S. Lindsey Expanded Scope of Synthetic Bacteriochlorins via Improved Acid Catalysis Conditions and Diverse Dihydrodipyrrin-Acetals Journal of Organic Chemistry, 2010, 75, 1016-1039 |
4029189 | CIF | C10 H8 N2 O | P 1 21/c 1 | 14.469; 5.222; 10.7063 90; 91.703; 90 | 808.58 | Gutekunst, Will R.; Baran, Phil S. Applications of C-h functionalization logic to cyclobutane synthesis. The Journal of organic chemistry, 2014, 79, 2430-2452 |
4027559 | CIF | C10 H8 N2 O S | P -1 | 8.3539; 9.2782; 13.883 101.664; 90.914; 115.71 | 942.9 | Yongmei Zhao; Yanmiao Wu; Jiong Jia; Dongju Zhang; Chen Ma One-Pot Synthesis of Benzo[1,4]thiazin-3(4H)-ones and a Theoretical Study of the S-N Type Smiles Rearrangement Mechanism Journal of Organic Chemistry, 2012, 77, 8501-8506 |
4021232 | CIF | C10 H8 N2 O2 | P c c n | 14.4551; 16.5721; 8.0504 90; 90; 90 | 1928.48 | Amit Basak; Subhendu Sekhar Bag; Pooja Anjali Majumder; Amit Kumar Das; Valerio Bertolasi Effect of Remote Trigonal Carbons on the Kinetics of Bergman Cyclization: Synthesis and Chemical Reactivity of Pyridazinedione-Based Enediynes Journal of Organic Chemistry, 2004, 69, 6927-6930 |
4028219 | CIF | C10 H8 N2 O2 | P b c a | 12.0523; 7.62; 19.0289 90; 90; 90 | 1747.6 | Fabrício F. Naciuk; Julio C. Milan; Almir Andreão; Paulo C. M. L. Miranda Exploitation of a Tuned Oxidation with N-Haloimides in the Synthesis of Caulibugulones A-D Journal of Organic Chemistry, 2013, 78, 5026-5030 |
4032402 | CIF | C10 H8 N2 O2 S | P -1 | 4.5638; 7.0494; 15.476 95.825; 95.748; 99.306 | 485.3 | McCaw, Patrick G.; Buckley, Naomi M.; Eccles, Kevin S.; Lawrence, Simon E.; Maguire, Anita R.; Collins, Stuart G. Synthesis of Cyclic α-Diazo-β-keto Sulfoxides in Batch and Continuous Flow. The Journal of organic chemistry, 2017, 82, 3666-3679 |
4035688 | CIF | C10 H8 N2 O3 | P 1 21/c 1 | 11.0445; 5.4776; 15.3754 90; 100.641; 90 | 914.18 | Szostak, Roman; Liu, Chengwei; Lalancette, Roger; Szostak, Michal Twisted N-Acyl-hydantoins: Rotationally Inverted Urea-Imides of Relevance in N-C(O) Cross-coupling. The Journal of organic chemistry, 2018, 83, 14676-14682 |
4033526 | CIF | C10 H8 N2 O7 | P 21 21 21 | 5.364; 10.4478; 19.1395 90; 90; 90 | 1072.62 | Cleveland, Alexander H.; Fronczek, Frank R.; Kartika, Rendy Synthesis of Vicinal Dichlorides via Activation of Aliphatic Terminal Epoxides with Triphosgene and Pyridine. The Journal of organic chemistry, 2018, 83, 3367-3377 |
4038729 | CIF | C10 H8 N2 S | P -1 | 9.2794; 9.3445; 10.356 89.2189; 89.7152; 82.646 | 890.51 | Wang, Haofeng; Wu, Xin; Wang, Luyu; Li, Erfei; Li, Xiaoyu; Tong, Tao; Kang, Honglan; Xie, Jian-Wu; Shen, Guodong; Lv, Xin One-Pot Synthesis of Benzimidazo[2,1-b]thiazoline Derivatives through An Addition/Cyclization/Oxidative Coupling Reaction. The Journal of organic chemistry, 2020 |
4025174 | CIF | C10 H8 N2 S2 | P 1 21/c 1 | 8.0071; 6.5112; 10.013 90; 112.755; 90 | 481.4 | Jared F. Mike; Jeremy J. Inteman; Arkady Ellern; Malika Jeffries-EL Facile Synthesis of 2,6-Disubstituted Benzobisthiazoles: Functional Monomers for the Design of Organic Semiconductors Journal of Organic Chemistry, 2010, 75, 495-497 |
4031898 | CIF | C10 H8 N4 O0 | P n a 21 | 9.1089; 9.794; 10.309 90; 90; 90 | 919.7 | Sun, Kai; Zhu, Zhonghong; Sun, Jingjing; Liu, Lulu; Wang, Xin Copper-Catalyzed N-Arylation of Azoles and Mannich-Type Coupling of Ketones and Azoles under Metal-Free Conditions. The Journal of organic chemistry, 2016, 81, 1476-1483 |
4033861 | CIF | C10 H8 N6 | P 1 21 1 | 5.5409; 8.9312; 10.2919 90; 93.877; 90 | 508.15 | Yang, Hongwei; Huang, Liping; Xu, Minxian; Tang, Yongxing; Wang, Bohan; Cheng, Guangbin Strategy for Extending the Nitrogen Chain: The Bis(1,2,3-triazole) Formation Reaction from Tosylhydrazones and <i>N</i>-Amino Azole. The Journal of organic chemistry, 2019, 84, 10629-10634 |
4037236 | CIF | C10 H8 O S3 | P 1 21/n 1 | 7.5233; 13.4451; 10.8452 90; 104.929; 90 | 1060 | Koley, Suvajit; Chanda, Tanmoy; Samai, Subhasis; Singh, Maya Shankar Switching Selectivity of α-Enolic Dithioesters: One Pot Access to Functionalized 1,2- and 1,3-Dithioles. The Journal of organic chemistry, 2016, 81, 11594-11602 |
4027223 | CIF | C10 H8 O2 | P 1 21 1 | 4.05; 16.162; 5.946 90; 94.298; 90 | 388.1 | Veerababurao Kavala; Cheng-Chuan Wang; Deepak Kumar Barange; Chun-Wei Kuo; Po-Min Lei; Ching-Fa Yao Synthesis of Isocoumarin Derivatives via the Copper-Catalyzed Tandem Sequential Cyclization of 2- Halo-N-phenyl Benzamides and Acyclic 1,3-Diketones Journal of Organic Chemistry, 2012, 77, 5022-5029 |
4020322 | CIF | C10 H8 O4 | C 1 2/c 1 | 11.9211; 8.406; 9.7895 90; 124.064; 90 | 812.67 | María Victoria Roux; Juan Z. Dávalos; Pilar Jiménez; Rafael Notario; Obis Castaño; James S. Chickos; William Hanshaw; Hui Zhao; Nigam Rath; Joel F. Liebman; Behzad S. Farivar; A. Bashir-Hashemi Journal of Organic Chemistry, 2005, 70, 5461-5470 |
4034663 | CIF | C10 H8 S3 | P -1 | 7.3636; 8.0204; 18.386 90.452; 94.406; 105.314 | 1043.8 | Xu, Hong-Hui; Zhang, Xiao-Hong; Zhang, Xing-Guo Copper-Catalyzed Tandem Sulfuration/Annulation of Propargylamines with Sulfur via C-N Bond Cleavage. The Journal of organic chemistry, 2019, 84, 7894-7900 |
4026257 | CIF | C10 H9 B Br2 F2 O6 | P 1 21/c 1 | 6.778; 10.779; 18.776 90; 99.987; 90 | 1351 | Faiz Ahmed Khan; Ch. Nageswara Rao Grob Fragmentation of Norbornyl α-Diketones: A Route to α-Ketoenols and Aromatic Compounds Journal of Organic Chemistry, 2011, 76, 3320-3328 |
4036698 | CIF | C10 H9 Br Cl N3 O2 | P 21 21 21 | 8.477; 10.9753; 25.6472 90; 90; 90 | 2386.15 | Joshi-Pangu, Amruta; Cohen, Ryan D.; Tudge, Matthew T.; Chen, Yonggang Dearomatization of Electron-Deficient Nitrogen Heterocycles via Cobalt-Catalyzed Asymmetric Cyclopropanation. The Journal of organic chemistry, 2016, 81, 3070-3075 |
4029883 | CIF | C10 H9 Br O | P 21 21 21 | 4.8383; 16.347; 23.195 90; 90; 90 | 1834.5 | Tada, Atsuo; Tokoro, Yuichiro; Fukuzawa, Shin-Ichi Palladium/ClickFerrophos-Catalyzed Asymmetric Domino Allylstannylation-Heck Reaction of o-Formylaryl Triflate. The Journal of organic chemistry, 2014, 79, 7905-7909 |
4027631 | CIF | C10 H9 Br O2 | P b c a | 9.0384; 7.883; 27.4231 90; 90; 90 | 1953.89 | Shah Jaimin Balkrishna; Ch Durga Prasad; Piyush Panini; Michael R. Detty; Deepak Chopra; Sangit Kumar Isoselenazolones as Catalysts for the Activation of Bromine: Bromolactonization of Alkenoic Acids and Oxidation of Alcohols Journal of Organic Chemistry, 2012, 77, 9541-9552 |
4025315 | CIF | C10 H9 Br2 Cl N2 O3 | P 21 21 21 | 9.61; 11.493; 12.112 90; 90; 90 | 1337.7 | Zhan-Guo Chen; Yun Wang; Jun-Fa Wei; Peng-Fei Zhao; Xian-Ying Shi K3PO4-Catalyzed Regiospecific Aminobromination of β-Nitrostyrene Derivatives with N-Bromoacetamide as Aminobrominating Agent Journal of Organic Chemistry, 2010, 75, 2085-2088 |
4021587 | CIF | C10 H9 Br2 N O2 S | P 1 21/c 1 | 11.1336; 8.6732; 12.584 90; 111.078; 90 | 1133.86 | Robert D. Dura; Leo A. Paquette Ring Contraction of Bridgehead Sultams by Photoinduced Di-π-methane Rearrangement Journal of Organic Chemistry, 2006, 71, 2456-2459 |
4024392 | CIF | C10 H9 Br2 N O3 | P 1 21/a 1 | 7.3612; 11.0472; 15.508 90; 102.165; 90 | 1232.8 | Bichismita Sahu; Guddeangadi N. Gururaja; Shaikh M. Mobin; Irishi N. N. Namboothiri Facile Synthesis of β-Tribromomethyl and Dibromomethylenated Nitroalkanes via Conjugate Addition of Bromoform to Nitroalkenes Journal of Organic Chemistry, 2009, 74, 2601-2604 |
4034037 | CIF | C10 H9 Cl F N O2 | P -1 | 4.6067; 9.4142; 11.9555 84.496; 87.781; 89.35 | 515.7 | Tang, Lin; Yang, Zhen; Jiao, Jingchao; Cui, Ying; Zou, Guodong; Zhou, Qiuju; Zhou, Yuqiang; Rao, Weihao; Ma, Xiantao Chemoselective Mono- and Difluorination of 1,3-Dicarbonyl Compounds. The Journal of organic chemistry, 2019, 84, 10449-10458 |
4035000 | CIF | C10 H9 Cl N2 O2 | C 1 2/c 1 | 19.224; 10.624; 14.616 90; 136.066; 90 | 2071 | Maity, Rajib; Naskar, Sandip; Das, Indrajit Copper(II)-Catalyzed Reactions of α-Keto Thioesters with Azides via C-C and C-S Bond Cleavages: Synthesis of N-Acylureas and Amides. The Journal of organic chemistry, 2018, 83, 2114-2124 |
4036513 | CIF | C10 H9 Cl O3 | P -1 | 5.1208; 7.8498; 11.9863 99.256; 91.114; 100.217 | 467.43 | Olomola, Temitope O.; Klein, Rosalyn; Caira, Mino R.; Kaye, Perry T. Elucidating Latent Mechanistic Complexity in Competing Acid-Catalyzed Reactions of Salicylaldehyde-Derived Baylis-Hillman Adducts. The Journal of organic chemistry, 2016, 81, 109-120 |
4036007 | CIF | C10 H9 F3 N2 O4 | P -1 | 4.6612; 8.2732; 15.4139 81.641; 82.204; 80.603 | 576.37 | Wan, Yameng; Zhang, Zhiguo; Ma, Nana; Bi, Jingjing; Zhang, Guisheng Acylamino-Directed Specific Sequential Difunctionalizations of Anilides via Metal-Free Relay Reactions for p-Oxygen and o-Nitrogen Incorporation. The Journal of organic chemistry, 2019, 84, 780-791 |
4024198 | CIF | C10 H9 F5 N O4 P | P b c a | 11.1322; 9.4331; 25.1364 90; 90; 90 | 2639.6 | Jinhua Song; Hiroshi Yamataka; Zvi Rappoport Dialkoxyphosphinyl-Substituted Enols of Carboxamides Journal of Organic Chemistry, 2007, 72, 7605-7624 |
4021633 | CIF | C10 H9 Fe N3 | P 21 21 21 | 7.4498; 10.6899; 11.6023 90; 90; 90 | 923.98 | Peter Walla; Vladimir B. Arion; Udo H. Brinker Solvent- and Temperature-Tuned Orientation of Ferrocenyl Azide Inside β-Cyclodextrin Journal of Organic Chemistry, 2006, 71, 3274-3277 |
4023665 | CIF | C10 H9 I N2 S | C 1 c 1 | 13.059; 11.001; 15.34 90; 97.15; 90 | 2186.6 | Prosper Nshimyumukiz; Olivier Fasbender; Bernard Tinant; Jacqueline Marchand-Brynaert; Francis Darro; Raphaël Robiette Divergent and Regioselective Synthesis of 1,2,4- and 1,2,5-Trisubstituted Imidazoles Journal of Organic Chemistry, 2008, 73, 6816-6823 |
4033407 | CIF | C10 H9 I O | C 1 2/c 1 | 19.0529; 6.5875; 15.1398 90; 103.068; 90 | 1851 | Ilie, Adriana; Harms, Klaus; Reetz, Manfred T. P450-Catalyzed Regio- and Stereoselective Oxidative Hydroxylation of 6-Iodotetralone: Preparative-Scale Synthesis of a Key Intermediate for Pd-Catalyzed Transformations. The Journal of organic chemistry, 2018, 83, 7504-7508 |
4033406 | CIF | C10 H9 I O2 | P 21 21 21 | 4.9774; 12.0515; 15.8253 90; 90; 90 | 949.28 | Ilie, Adriana; Harms, Klaus; Reetz, Manfred T. P450-Catalyzed Regio- and Stereoselective Oxidative Hydroxylation of 6-Iodotetralone: Preparative-Scale Synthesis of a Key Intermediate for Pd-Catalyzed Transformations. The Journal of organic chemistry, 2018, 83, 7504-7508 |
4034107 | CIF | C10 H9 N O2 | P b c a | 8.431; 9.685; 20.623 90; 90; 90 | 1684 | Li, Ming; Wang, Jia-Hui; Li, Wei; Lin, Cheng-Dong; Zhang, Lin-Bao; Wen, Li-Rong N-Phenoxyamides as Multitasking Reagents: Base-Controlled Selective Construction of Benzofurans or Dihydrobenzofuro[2,3- d]oxazoles. The Journal of organic chemistry, 2019, 84, 8523-8530 |
4037854 | CIF | C10 H9 N O3 S | P 1 21/n 1 | 5.29; 16.4483; 12.6312 90; 93.837; 90 | 1096.6 | Bracken, Cormac; Baumann, Marcus Development of a Continuous Flow Photoisomerization Reaction Converting Isoxazoles into Diverse Oxazole Products. The Journal of organic chemistry, 2020 |
4020603 | CIF | C10 H9 N O4 | P -1 | 10.0106; 10.4397; 11.6615 68.051; 67.541; 70.203 | 1017 | Liwen He; G. S. C. Srikanth; Steven L. Castle Synthesis of β-Substituted α-Amino Acids via Lewis Acid Promoted Enantioselective Radical Conjugate Additions Journal of Organic Chemistry, 2005, 70, 8140-8147 |
4033315 | CIF | C10 H9 N O5 S | P 1 21/n 1 | 13.4331; 5.37; 28.625 90; 97.81; 90 | 2045.73 | Yoshimura, Akira; Nguyen, Khiem C.; Rohde, Gregory T.; Postnikov, Pavel S.; Yusubov, Mekhman S.; Zhdankin, Viktor V. Hypervalent Iodine Reagent Mediated Oxidative Heterocyclization of Aldoximes with Heterocyclic Alkenes. The Journal of organic chemistry, 2017, 82, 11742-11751 |
4037462 | CIF | C10 H9 N3 O | P 1 21/c 1 | 6.8354; 11.3494; 12.139 90; 104.352; 90 | 912.33 | Castillo, Juan-Carlos; Estupiñan, Diego; Nogueras, Manuel; Cobo, Justo; Portilla, Jaime 6-(Aryldiazenyl)pyrazolo[1,5-a]pyrimidines as Strategic Intermediates for the Synthesis of Pyrazolo[5,1-b]purines. The Journal of organic chemistry, 2016, 81, 12364-12373 |
4032784 | CIF | C10 H9 N3 O2 | P n a 21 | 21.142; 4.242; 10.6198 90; 90; 90 | 952.43 | Huang, Adrian; Wo, Kellie; Lee, So Yeun Christine; Kneitschel, Nika; Chang, Jennifer; Zhu, Kathleen; Mello, Tatsiana; Bancroft, Laura; Norman, Natalie J.; Zheng, Shao-Liang Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles. The Journal of organic chemistry, 2017, 82, 8864-8872 |
4032804 | CIF | C10 H9 N3 O2 | P 21 21 21 | 3.9074; 12.9574; 18.5066 90; 90; 90 | 936.98 | Huang, Adrian; Wo, Kellie; Lee, So Yeun Christine; Kneitschel, Nika; Chang, Jennifer; Zhu, Kathleen; Mello, Tatsiana; Bancroft, Laura; Norman, Natalie J.; Zheng, Shao-Liang Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles. The Journal of organic chemistry, 2017, 82, 8864-8872 |
4032796 | CIF | C10 H9 N3 O4 S | P 1 2/c 1 | 13.7446; 10.6979; 16.3339 90; 110.418; 90 | 2250.8 | Huang, Adrian; Wo, Kellie; Lee, So Yeun Christine; Kneitschel, Nika; Chang, Jennifer; Zhu, Kathleen; Mello, Tatsiana; Bancroft, Laura; Norman, Natalie J.; Zheng, Shao-Liang Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles. The Journal of organic chemistry, 2017, 82, 8864-8872 |
4032481 | CIF | C10 H9 N5 O | P 1 21/c 1 | 10.062; 7.286; 27.054 90; 105.89; 90 | 1907.6 | Centore, Roberto; Manfredi, Carla; Capobianco, Amedeo; Volino, Sabato; Ferrara, Maria Vittoria; Carella, Antonio; Fusco, Sandra; Peluso, Andrea Solid State Separation and Isolation of Tautomers of Fused-Ring Triazolotriazoles. The Journal of organic chemistry, 2017 |
4036574 | CIF | C10.15 H7.69 Cl1.54 N0.62 | P -1 | 10.5292; 11.7378; 25.986 81.345; 85.62; 68.07 | 2944.6 | Zhang, Yu-Fei; Tian, Wan-Fa; Cao, Xiao-Ping; Kuck, Dietmar; Chow, Hak-Fun o-Quinones Derived from Tribenzotriquinacenes: Functionalization of Inner Bay Positions and Use for Single-Wing Extensions. The Journal of organic chemistry, 2016, 81, 2308-2319 |
4024936 | CIF | C10.67 H17 N2.33 O2 | R -3 :H | 18.7559; 18.7559; 16.2998 90; 90; 120 | 4965.79 | Bret R. Van Ausdall; Jeremy L. Glass; Kelly M. Wiggins; Atta M. Aarif; Janis Louie A Systematic Investigation of Factors Influencing the Decarboxylation of Imidazolium Carboxylates Journal of Organic Chemistry, 2009, 74, 7935-7942 |
4023435 | CIF | C100 H100 N4 O12 | P -1 | 8.9172; 13.684; 18.767 70.989; 76.628; 74.113 | 2056.7 | Shin-ichiro Kato; Yasuhiro Nonaka; Toshiaki Shimasaki; Kenta Goto; Teruo Shinmyozu Novel Pyromellitic Diimide-Based Macrocycle with a Linear π-Electronic System and Bis(phenylethynyl)pyromellitic Diimide: Syntheses, Structures, Photophysical Properties, and Redox Characteristics Journal of Organic Chemistry, 2008, 73, 4063-4075 |
4028120 | CIF | C100 H112 Br2 F12 N2 O20 P2 | P -1 | 11.783; 15.157; 15.464 104.62; 99.12; 110.08 | 2416.9 | Ying Han; Jing Cao; Peng-Fei Li; Qian-Shou Zong; Jian-Min Zhao; Jia-Bin Guo; Jun-Feng Xiang; Chuan-Feng Chen Complexation of Triptycene-Derived Macrotricyclic Polyether with Paraquat Derivatives, Diquat, and a 2,7-Diazapyrenium Salt: Guest-Induced Conformational Changes of the Host Journal of Organic Chemistry, 2013, 78, 3235-3242 |
4028119 | CIF | C100 H112 Cl2 F12 N2 O20 P2 | P -1 | 11.819; 15.066; 15.443 104.587; 98.719; 110.301 | 2407.9 | Ying Han; Jing Cao; Peng-Fei Li; Qian-Shou Zong; Jian-Min Zhao; Jia-Bin Guo; Jun-Feng Xiang; Chuan-Feng Chen Complexation of Triptycene-Derived Macrotricyclic Polyether with Paraquat Derivatives, Diquat, and a 2,7-Diazapyrenium Salt: Guest-Induced Conformational Changes of the Host Journal of Organic Chemistry, 2013, 78, 3235-3242 |
4024490 | CIF | C100 H120 N8 | P 1 21/c 1 | 25.9786; 16.6372; 20.7138 90; 105.282; 90 | 8636.2 | Megumi Mori; Toshifumi Okawa; Noriko Iizuna; Kana Nakayama; Juha M. Lintuluoto; Jun-ichiro Setsune Dynamic Figure Eight Loop Structure ofmeso-Tetraaryl[32]octaphyrins(1.0.1.0.1.0.1.0) Journal of Organic Chemistry, 2009, 74, 3579-3582 |
4037559 | CIF | C100 H122 O25 | P 21 21 2 | 23.323; 25.0931; 7.6786 90; 90; 90 | 4493.87 | Li, Qin; Chen, Chunmei; Cheng, Li; Wei, Mengsha; Dai, Chong; He, Yan; Gong, Jiaojiao; Zhu, Runqi; Li, Xiao-Nian; Liu, Junjun; Wang, Jianping; Zhu, Hucheng; Zhang, Yonghui Emeridones A-F, a Series of 3,5-Demethylorsellinic Acid-Based Meroterpenoids with Rearranged Skeletons from an Endophytic Fungus Emericella sp. TJ29. The Journal of organic chemistry, 2019, 84, 1534-1541 |
4038044 | CIF | C100 H142 Br4 Cl2 N4 O28 Si4 | P c c n | 24.66; 32.376; 14.076 90; 90; 90 | 11238.2 | Yu, Haiyong; Tian, Yingyuan; Zong, Yan; Zhang, Jianyu; Xu, Tao Total Synthesis and Structural Reassignment of Aranorosinol A, Aranorosinol B, and EI-2128-1. The Journal of organic chemistry, 2020 |
4035190 | CIF | C100 H67 Cl3 O6 | P 1 21/c 1 | 24.871; 16.1571; 22.4581 90; 108.057; 90 | 8580.2 | Wang, Jia-Qi; Li, Jing; Zhang, Geng-Wu; Chen, Chuan-Feng A Route to Enantiopure ( O-Methyl)<sub>6</sub>-2,6-Helic[6]arenes: Synthesis of Hexabromo-Substituted 2,6-Helic[6]arene Derivatives and Their Suzuki-Miyaura Coupling Reactions. The Journal of organic chemistry, 2018, 83, 11532-11540 |
4033413 | CIF | C100 H70 Cl12 Cu6 N12 S6 | P -1 | 12.8655; 14.159; 16.1031 115.333; 104.641; 96.319 | 2484.1 | Zhang, Meng-Juan; Tan, Da-Wei; Li, Hong-Xi; Young, David James; Wang, Hui-Fang; Li, Hai-Yan; Lang, Jian-Ping Switchable Chemoselective Transfer Hydrogenations of Unsaturated Carbonyls Using Copper(I) N-Donor Thiolate Clusters. The Journal of organic chemistry, 2018, 83, 1204-1215 |
4021234 | CIF | C100.5 H117 N4 O4.5 | P 1 21/c 1 | 23.275; 18.33; 22.8247 90; 116.592; 90 | 8707.8 | Jonathan P. Hill; Ian J. Hewitt; Christopher E. Anson; Annie K. Powell; Amy Lea McCarty; Paul A. Karr; Melvin E. Zandler; Francis D'Souza Highly Nonplanar, Electron Deficient, N-Substituted tetra-Oxocyclohexadienylidene Porphyrinogens: Structural, Computational, and Electrochemical Investigations Journal of Organic Chemistry, 2004, 69, 5861-5869 |
4029190 | CIF | C101 H104 Cl6 N8 O18 Pd S4 Si2 | P -1 | 14.882; 15.8; 25.597 74.962; 85.165; 66.031 | 5310 | Gutekunst, Will R.; Baran, Phil S. Applications of C-h functionalization logic to cyclobutane synthesis. The Journal of organic chemistry, 2014, 79, 2430-2452 |
4030572 | CIF | C101 H109 N O4 S3 Si3 | P n m a | 21.924; 37.2892; 10.7444 90; 90; 90 | 8783.9 | Hammer, Natalie; Shubina, Tatyana E.; Gisselbrecht, Jean-Paul; Hampel, Frank; Kivala, Milan Synthesis and properties of arylvinylidene-bridged triphenylamines. The Journal of organic chemistry, 2015, 80, 2418-2424 |
4034804 | CIF | C101 H122 Cl2 O2 Si2 | P -1 | 13.0957; 19.0281; 19.8599 68.022; 88.534; 87.009 | 4582.8 | Nagaoka, Maiko; Tsurumaki, Eiji; Nishiuchi, Mai; Iwanaga, Tetsuo; Toyota, Shinji Synthesis and Electronic Properties of Length-Defined 9,10-Anthrylene-Butadiynylene Oligomers. The Journal of organic chemistry, 2018, 83, 5784-5790 |
4020137 | CIF | C101 H132 N4 O44 | P 1 21 1 | 19.0391; 11.1986; 23.9408 90; 95.338; 90 | 5082.3 | Huifang Wu; Denzil Bernard; Weibin Chen; Gary D. Strahan; Jeffrey R. Deschamps; Damon A. Parrish; John W. Lewis; Alexander D. MacKerell, Jr.; Andrew Coop Journal of Organic Chemistry, 2005, 70, 1907-1910 |
4027124 | CIF | C101 H138 B4 N8 O8 | P -1 | 12.8615; 19.9997; 20.5839 83.399; 76.527; 89.713 | 5113.57 | Deborah A. Smithen; Alexander E. G. Baker; Matthew Offman; Sarah M. Crawford; T. Stanley Cameron; Alison Thompson Use of F-BODIPYs as a Protection Strategy for Dipyrrins: Optimization of BF2Removal Journal of Organic Chemistry, 2012, 77, 3439-3453 |
4031770 | CIF | C101 H57 B2 F40 N2 O4 | P b c a | 22.6937; 25.4639; 31.677 90; 90; 90 | 18305 | Kurata, Ryohei; Tanaka, Kazuyoshi; Ito, Akihiro Isolation and Characterization of Persistent Radical Cation and Dication of 2,7-Bis(dianisylamino)pyrene. The Journal of organic chemistry, 2016, 81, 137-145 |
4029667 | CIF | C101 H78 N10 Ni2 O2 | P -1 | 10.1608; 13.0894; 15.4826 75.664; 72.801; 86.751 | 1905.53 | Devillers, Charles H.; Hebié, Seydou; Lucas, Dominique; Cattey, Hélène; Clément, Sébastien; Richeter, Sébastien Aromatic Nucleophilic Substitution (SNAr) of meso-Nitroporphyrin with Azide and Amines as an Alternative Metal Catalyst Free Synthetic Approach To Obtain meso-N-Substituted Porphyrins. The Journal of organic chemistry, 2014, 79, 6424-6434 |
4024641 | CIF | C102 H103 F2 N12 O12 | C 1 2/c 1 | 14.1007; 35.769; 22.459 90; 118.483; 90 | 9956.5 | Hai-Yu Hu; Wei Xue; Zhi-Qiang Hu; Jun-Feng Xiang; Chuan-Feng Chen; Sheng-Gui He Probing the Dynamic Environment-Associated Conformational Conversion from Secondary to Supersecondary Structures in Oligo(phenanthroline dicarboxamide)s Journal of Organic Chemistry, 2009, 74, 4949-4957 |
4023188 | CIF | C102 H114 N6 | P -1 | 10.5896; 13.7649; 16.4623 65.295; 88.796; 74.881 | 2093.91 | Matthew Vale; Maren Pink; Suchada Rajca; Andrzej Rajca Synthesis, Structure, and Conformation of Aza[1~n~]metacyclophanes Journal of Organic Chemistry, 2008, 73, 27-35 |
4029165 | CIF | C102 H118 N24 O34 S | P -1 | 11.4144; 16.9099; 17.2091 115.692; 100.539; 98.828 | 2839.4 | Basu, Arghya; Das, Gopal A C3v-Symmetric Tripodal Urea Receptor for Anions and Ion Pairs: Formation of Dimeric Capsular Assemblies of the Receptor during Anion and Ion Pair Coordination. The Journal of organic chemistry, 2014, 79, 2647-2656 |
4038155 | CIF | C102 H126 N2 O23 | P -1 | 12.5897; 12.7023; 15.9641 77.76; 75.988; 73.191 | 2343.3 | Taimoory, S. Maryamdokht; Twum, Kwaku; Dashti, Mohadeseh; Pan, FangFang; Lahtinen, Manu; Rissanen, Kari; Puttreddy, Rakesh; Trant, John F.; Beyeh, Ngong Kodiah Bringing a Molecular Plus One: Synergistic Binding Creates Guest-Mediated Three Component Complexes. The Journal of organic chemistry, 2020 |
4020045 | CIF | C102 H129 F24 N7 O24 P4 | P 1 21/c 1 | 14.0015; 20.6348; 20.0547 90; 101.645; 90 | 5674.9 | Huang, Feihe; Zakharov, Lev N.; Rheingold, Arnold L.; Ashraf-Khorassani, Mehdi Synthesis of a Symmetric Cylindrical Bis(crown ether) Host and Its Complexation with Paraquat Journal of Organic Chemistry, 2005, 70, 809-813 |
4023170 | CIF | C102 H134 N4 O16 S4 | P 1 | 13.038; 14.627; 16.662 105.818; 99.498; 114.094 | 2649.2 | Akemi Ryoda; Nana Yajima; Toyokazu Haga; Takuya Kumamoto; Waka Nakanishi; Masatoshi Kawahata; Kentaro Yamaguchi; Tsutomu Ishikawa Optical Resolution of (\±)-1,2-Bis(2-methylphenyl)ethylene-1,2-diamine as a Chiral Framework for 2-Iminoimidazolidine with 2-Methylphenyl Pendant and the Guanidine-Catalyzed Asymmetric Michael Reaction of tert-Butyl Diphenyliminoacetate and Ethyl Acrylate Journal of Organic Chemistry, 2008, 73, 133-141 |
4035951 | CIF | C102 H24 Lu3 N3 O S2 | P b c a | 25.423; 15.6051; 28.953 90; 90; 90 | 11486 | Shen, Wangqiang; Yang, Le; Wu, Yongbo; Bao, Lipiao; Li, Ying; Jin, Peng; Fang, Hongyun; Xie, Yunpeng; Lu, Xing Reactions between N-Heterocyclic Carbene and Lutetium-Metallofullerenes: High Regioselectivity Directed by Electronic Effect in Addition to Steric Hindrance. The Journal of organic chemistry, 2019, 84, 606-612 |
4025052 | CIF | C103 H106 Cl3 N3 O24 | P -1 | 11.0982; 15.2542; 29.06 102.749; 96.537; 97.012 | 4711.9 | Masahide Tominaga; Hyuma Masu; Isao Azumaya Construction and Charge-Transfer Complexation of Adamantane-Based Macrocycles and a Cage with Aromatic Ring Moieties Journal of Organic Chemistry, 2009, 74, 8754-8760 |
4026618 | CIF | C103 H106.5 Cl2 Fe2 O0.25 P2 Pd2 | P 1 21/c 1 | 35.0455; 12.5496; 19.7679 90; 100.514; 90 | 8548.1 | Carin C. C. Johansson Seechurn; Sébastien L. Parisel; Thomas J. Colacot Air-Stable Pd(R-allyl)LCl (L= Q-Phos, P(t-Bu)3, etc.) Systems for C-C/N Couplings: Insight into the Structure-Activity Relationship and Catalyst Activation Pathway Journal of Organic Chemistry, 2011, 76, 7918-7932 |
4026656 | CIF | C103.5 H87 Cl9 O10.5 | P -1 | 17.069; 17.705; 18.548 96.854; 103.899; 117.17 | 4667.5 | Patrick Commins; Jose E. Nuñez; Miguel A. Garcia-Garibay Synthesis of Bridged Molecular Gyroscopes with Closed Topologies: Triple One-Pot Macrocyclization Journal of Organic Chemistry, 2011, 76, 8355-8363 |
4026777 | CIF | C104 H122 N8 | P 1 21 1 | 13.589; 21.416; 16.083 90; 90.573; 90 | 4680.3 | Shi Li; Zhiying Jia; Kiyohiko Nakajima; Ken-ichiro Kanno; Tamotsu Takahashi Dehydro Side Coupling of Substituted Pentacene Derivatives Journal of Organic Chemistry, 2011, 76, 9983-9987 |
4024833 | CIF | C104 H28 F30 O2 | P b c n | 17.8857; 25.3005; 31.4601 90; 90; 90 | 14236.2 | Yuta Takano; M. Ángeles Herranz; Ivan E. Kareev; Steven H. Strauss; Olga V. Boltalina; Takeshi Akasaka; Nazario Martín Efficient Regioselective [4+2] Cycloaddition of o-Quinodimethane to C70(CF3)10 Journal of Organic Chemistry, 2009, 74, 6902-6905 |
4032666 | CIF | C104 H70 Cl4 O9 | P 1 21/n 1 | 11.1137; 36.5155; 19.991 90; 96.49; 90 | 8060.8 | Shouda, Takaaki; Nakanishi, Kentaro; Sasamori, Takahiro; Tokitoh, Norihiro; Kuramochi, Kouji; Tsubaki, Kazunori Synthesis and Structures of Zigzag Shaped [12]Cyclo-p-phenylene Composed of Dinaphthofuran Units and Biphenyl Units. The Journal of organic chemistry, 2017 |
4038003 | CIF | C104 H76 B2 F8 N4 Pd | P 1 21/n 1 | 14.6049; 15.0018; 19.0646 90; 94.308; 90 | 4165.2 | Duong, Adam; Levesque, Alexandre; Homand, Clara; Maris, Thierry; Wuest, James D. Controlling Molecular Organization by Using Phenyl Embraces of Multiple Trityl Groups. The Journal of organic chemistry, 2020 |
4038008 | CIF | C104 H76 B2 F8 N4 Pd | P -1 | 9.039; 15.343; 22.08 72.242; 81.57; 81.354 | 2866.6 | Duong, Adam; Levesque, Alexandre; Homand, Clara; Maris, Thierry; Wuest, James D. Controlling Molecular Organization by Using Phenyl Embraces of Multiple Trityl Groups. The Journal of organic chemistry, 2020 |
4021954 | CIF | C104 H98 Cl24 O15 P4 | P 1 21 1 | 12.3799; 24.2382; 21.2644 90; 101.707; 90 | 6248 | Benoît Laleu; Gérald Bernardinelli; Remi Chauvin; Jérôme Lacour Trimesitylmethylphosphonium Cation. Supramolecular Stereocontrol and Simple Enantiomerization Mechanism Determination Journal of Organic Chemistry, 2006, 71, 7412-7416 |
4029126 | CIF | C104.21 H128.41 Cl0.41 N12 O22 | P 1 21/n 1 | 18.056; 20.067; 29.141 90; 103.002; 90 | 10288 | Singleton, Michael L.; Castellucci, Nicola; Massip, Stéphane; Kauffmann, Brice; Ferrand, Yann; Huc, Ivan Synthesis of 1,8-diazaanthracenes as building blocks for internally functionalized aromatic oligoamide foldamers. The Journal of organic chemistry, 2014, 79, 2115-2122 |
4027710 | CIF | C105 H114 I2 N4 O32 | P 21 21 21 | 19.5005; 21.6527; 24.7377 90; 90; 90 | 10445.2 | Claudine Schlemmer; Lars Andernach; Dieter Schollmeyer; Bernd F. Straub; Till Opatz Iodocyclization of o-Alkynylbenzamides Revisited: Formation of Isobenzofuran-1(3H)-imines and 1H-Isochromen-1-imines Instead of Lactams Journal of Organic Chemistry, 2012, 77, 10118-10124 |
4023873 | CIF | C105 H136 F24 N6 O35 P4 | P -1 | 13.9741; 16.8936; 26.4827 89.867; 81.082; 85.426 | 6156.3 | Adam M.-P. Pederson; Elizabeth M. Ward; Daniel V. Schoonover; Carla Slebodnick; Harry W. Gibson High-Yielding, Regiospecific Synthesis of cis(4,4')-Di(carbomethoxybenzo)-30-crown-10, Its Conversion to a Pyridyl Cryptand and Strong Complexation of 2,2'- and 4,4'-Bipyridinium Derivatives Journal of Organic Chemistry, 2008, 73, 9094-9101 |
4021431 | CIF | C105 H67 Cl15 N12 O13 | P 1 21/c 1 | 25.122; 12.103; 33.724 90; 102.191; 90 | 10023 | Erhong Hao; Frank R. Fronczek; M. Graça H. Vicente Synthesis of Oxacalixarene-Locked Bisporphyrins and Higher Oligomers Journal of Organic Chemistry, 2006, 71, 1233-1236 |
4024258 | CIF | C106 H104 O27 P6 | C 1 2/c 1 | 25.4815; 21.1342; 19.4278 90; 111.556; 90 | 9730.7 | Cécile Givelet; Bernard Tinant; Luc Van Meervelt; Thierry Buffeteau; Nathalie Marchand-Geneste; Brigitte Bibal Polyphosphorylated Triphenylenes: Synthesis, Crystal Structure, and Selective Catechol Recognition Journal of Organic Chemistry, 2009, 74, 652-659 |
4035496 | CIF | C106 H110 N2 O3 P2 | P 1 21 1 | 11.6873; 15.3134; 14.6013 90; 110.631; 90 | 2445.64 | Sun, Weiye; Gu, Haorui; Lin, Xufeng Synthesis and Application of Hexamethyl-1,1'-spirobiindane-Based Phosphine-Oxazoline Ligands in Ni-Catalyzed Asymmetric Arylation of Cyclic Aldimines. The Journal of organic chemistry, 2018, 83, 4034-4043 |
4035948 | CIF | C106 H24 Lu2 N2 S6 | P n m a | 21.244; 19.83; 14.957 90; 90; 90 | 6300.9 | Shen, Wangqiang; Yang, Le; Wu, Yongbo; Bao, Lipiao; Li, Ying; Jin, Peng; Fang, Hongyun; Xie, Yunpeng; Lu, Xing Reactions between N-Heterocyclic Carbene and Lutetium-Metallofullerenes: High Regioselectivity Directed by Electronic Effect in Addition to Steric Hindrance. The Journal of organic chemistry, 2019, 84, 606-612 |
4025440 | CIF | C106 H74 Cl18 N4 O8 | P -1 | 9.005; 16.454; 17.343 78.977; 88.847; 87.54 | 2519.8 | Koji Miki; Michiyasu Fujita; Yuki Inoue; Yoshinori Senda; Toshiyuki Kowada; Kouichi Ohe Synthesis of Strained Pyridine-Containing Cyclyne via Reductive Aromatization Journal of Organic Chemistry, 2010, 75, 3537-3540 |
4023871 | CIF | C106.08 H140.17 F24 N6 O33.69 P4 | P -1 | 13.9013; 17.2987; 26.7004 84.77; 76.048; 85.381 | 6194 | Adam M.-P. Pederson; Elizabeth M. Ward; Daniel V. Schoonover; Carla Slebodnick; Harry W. Gibson High-Yielding, Regiospecific Synthesis of cis(4,4')-Di(carbomethoxybenzo)-30-crown-10, Its Conversion to a Pyridyl Cryptand and Strong Complexation of 2,2'- and 4,4'-Bipyridinium Derivatives Journal of Organic Chemistry, 2008, 73, 9094-9101 |
4023558 | CIF | C107 H105.5 Cl4 N20.5 O28 | P -1 | 15.4848; 16.8763; 22.1548 87.8303; 70.8776; 83.9976 | 5440.1 | Soumyadip Ghosh; Anxin Wu; James C. Fettinger; Peter Y. Zavalij; Lyle Isaacs Self-Sorting Molecular Clips Journal of Organic Chemistry, 2008, 73, 5915-5925 |
4030966 | CIF | C107 H119 Cl3 N2 O14 | C 1 2/c 1 | 32.74; 14.888; 38.686 90; 99.017; 90 | 18624 | Bürger, M; Katzsch, F.; Brendler, E.; Gruber, T. Synthesis of macrocyclic receptors with intrinsic fluorescence featuring quinizarin moieties. The Journal of organic chemistry, 2015, 80, 4882-4892 |
4026547 | CIF | C107 H150 O17 | P -1 | 17.6991; 17.7612; 18.108 74.61; 77.744; 73.738 | 5209.8 | Katerina Kogan; Silvio E. Biali Conformationally Restricted Calix[8]arenes Substituted at All Methylene Bridges Journal of Organic Chemistry, 2011, 76, 7240-7244 |
4035949 | CIF | C107 H38 Lu3 N3 S0 | P 1 21/c 1 | 20.132; 20.735; 14.696 90; 90.598; 90 | 6134 | Shen, Wangqiang; Yang, Le; Wu, Yongbo; Bao, Lipiao; Li, Ying; Jin, Peng; Fang, Hongyun; Xie, Yunpeng; Lu, Xing Reactions between N-Heterocyclic Carbene and Lutetium-Metallofullerenes: High Regioselectivity Directed by Electronic Effect in Addition to Steric Hindrance. The Journal of organic chemistry, 2019, 84, 606-612 |
4022966 | CIF | C107.5 H126 N4 O6 Y2 | P 21 21 21 | 17.9792; 19.2948; 30.509 90; 90; 90 | 10583.7 | Biswajit Saha; Mei-Huey Lin; T. V. RajanBabu Exceptionally Active Yttrium-Salen Complexes for the Catalyzed Ring Opening of Epoxides by TMSCN and TMSN~3~ Journal of Organic Chemistry, 2007, 72, 8648-8655 |
4024529 | CIF | C108 H138 Br6 N12 O24 | P 1 21 1 | 14.5166; 28.6529; 15.3841 90; 104.305; 90 | 6200.5 | Andreas A. Grauer; Chiara Cabrele; Manfred Zabel; Burkhard König Stable Right- and Left-Handed Peptide Helices containing Cα-Tetrasubstituted α-Amino Acids Journal of Organic Chemistry, 2009, 74, 3718-3726 |
4038946 | CIF | C108 H162 N20 O26 S8 | P -1 | 11.154; 14.2902; 19.7538 100.214; 90.119; 95.774 | 3082.4 | Beaudoin, Daniel; Blair-Pereira, Joao-Nicolas; Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Predictably Ordered Open Hydrogen-Bonded Networks Built from Indeno[1,2-b]fluorenes. The Journal of organic chemistry, 2017, 82, 8536-8547 |
4031087 | CIF | C108 H90 Br12 N6 | P -1 | 14.207; 18.011; 20.025 89.45; 74.45; 88.09 | 4934 | Myśliwiec, Damian; Lis, Tadeusz; Gregoliński, Janusz; Stępień, Marcin Stereoselective Wittig Olefination as a Macrocyclization Tool. Synthesis of Large Carbazolophanes. The Journal of organic chemistry, 2015, 80, 6300-6312 |
4035592 | CIF | C109 H103 Cl3 O24 | R 3 :H | 30.9223; 30.9223; 8.3338 90; 90; 120 | 6901.08 | Su, Jun-Cheng; Wang, Shan; Cheng, Wen; Huang, Xiao-Jun; Li, Man-Mei; Jiang, Ren-Wang; Li, Yao-Lan; Wang, Lei; Ye, Wen-Cai; Wang, Ying Phloroglucinol Derivatives with Unusual Skeletons from Cleistocalyx operculatus and Their in Vitro Antiviral Activity. The Journal of organic chemistry, 2018, 83, 8522-8532 |
4026019 | CIF | C109 H125 Cl3 O48 P4 | C 1 2/c 1 | 17.863; 24.4265; 16.784 90; 118.377; 90 | 6443.4 | K. V. Sajna; Ramesh Kotikalapudi; Manab Chakravarty; N. N. Bhuvan Kumar; K. C. Kumara Swamy Cycloaddition Reactions of Allenylphosphonates and Related Allenes with Dialkyl Acetylenedicarboxylates, 1,3-Diphenylisobenzofuran, and Anthracene Journal of Organic Chemistry, 2011, 76, 920-938 |
4024851 | CIF | C109 H162 O11 P8 Pt4 | P 1 21 1 | 15.5715; 14.5131; 25.4337 90; 99.93; 90 | 5661.7 | Hai-Bo Yang; Brian H. Northrop; Yao-Rong Zheng; Koushik Ghosh; Peter J. Stang Facile Self-Assembly of Neutral Dendritic Metallocycles via Oxygen-to-Platinum Coordination Journal of Organic Chemistry, 2009, 74, 7067-7074 |
4038951 | CIF | C109 H28 N12 S6 | P a -3 | 18.9035; 18.9035; 18.9035 90; 90; 90 | 6755 | Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Molecular Organization of 2,1,3-Benzothiadiazoles in the Solid State. The Journal of organic chemistry, 2017, 82, 5034-5045 |
4022812 | CIF | C109 H56 Co N4 | P -1 | 14.0652; 14.3088; 17.4459 87.15; 75.536; 76.178 | 3301.2 | Min Zheng; Fangfang Li; Zujin Shi; Xiang Gao; Karl M. Kadish Electrosynthesis and Characterization of 1,2-Dibenzyl C~60~: A Revisit Journal of Organic Chemistry, 2007, 72, 2538-2542 |
4023006 | CIF | C109.32 H138.08 Cl2 F4 N14 O12 P2 | C 1 2/c 1 | 49.4376; 15.8172; 27.3399 90; 91.361; 90 | 21372.8 | Kenichi Calderon-Kawasaki; Sumith Kularatne; Yue Hu Li; Bruce C. Noll; W. Robert Scheidt; Dennis H. Burns Synthesis of Urea Picket Porphyrins and Their Use in the Elucidation of the Role Buried Solvent Plays in the Selectivity and Stoichiometry of Anion Binding Receptors Journal of Organic Chemistry, 2007, 72, 9081-9087 |
4032391 | CIF | C109.5 H36 N3 S5 Sc3 | P -1 | 10.9903; 17.558; 19.758 99.562; 105.779; 107.217 | 3376.1 | Chen, Muqing; Shen, Wangqiang; Peng, Ping; Bao, Lipiao; Zhao, Shasha; Xie, Yunpeng; Jin, Peng; Fang, Hongyun; Li, Fang-Fang; Lu, Xing Evidence of Oxygen Activation in the Reaction between an N-Heterocyclic Carbene and M3N@Ih(7)-C80: An Unexpected Method of Steric Hindrance Release. The Journal of organic chemistry, 2017, 82, 3500-3505 |
4036529 | CIF | C11 H10 Br F3 O6 S | P 1 21/c 1 | 17.8748; 7.8647; 10.3954 90; 105.882; 90 | 1405.6 | Horn, Evan J.; Silverston, Joel S.; Vanderwal, Christopher D. A Failed Late-Stage Epimerization Thwarts an Approach to Ineleganolide. The Journal of organic chemistry, 2016, 81, 1819-1838 |
4029889 | CIF | C11 H10 Br N O S | P -1 | 6.1759; 11.8443; 15.9609 85.25; 86.847; 88.964 | 1161.6 | Chen, Xiao-Lan; Li, Xu; Qu, Ling-Bo; Tang, Yu-Chun; Mai, Wen-Peng; Wei, Dong-Hui; Bi, Wen-Zhu; Duan, Li-Kun; Sun, Kai; Chen, Jian-Yu; Ke, Dian-Dian; Zhao, Yu-Fen Peroxides as "Switches" of Dialkyl H-Phosphonate: Two Mild and Metal-Free Methods for Preparation of 2-Acylbenzothiazoles and Dialkyl Benzothiazol-2-ylphosphonates. The Journal of organic chemistry, 2014, 79, 8407-8416 |
4032561 | CIF | C11 H10 Br2 N4 O | P 1 21/n 1 | 9.9156; 12.085; 12.04 90; 112.791; 90 | 1330.1 | Deng, Xiaocong; Lei, Xue; Nie, Gang; Jia, Lihui; Li, Yuanxiang; Chen, Yunfeng Copper-Catalyzed Cross-Dehydrogenative N(2)-Coupling of NH-1,2,3-Triazoles with N,N -Dialkylamides: N-Amidoalkylation of NH-1,2,3-Triazoles. The Journal of organic chemistry, 2017, 82, 6163-6171 |
4032562 | CIF | C11 H10 Br2 N4 O | P 1 21/c 1 | 14.851; 6.8378; 13.732 90; 109.703; 90 | 1312.8 | Deng, Xiaocong; Lei, Xue; Nie, Gang; Jia, Lihui; Li, Yuanxiang; Chen, Yunfeng Copper-Catalyzed Cross-Dehydrogenative N(2)-Coupling of NH-1,2,3-Triazoles with N,N -Dialkylamides: N-Amidoalkylation of NH-1,2,3-Triazoles. The Journal of organic chemistry, 2017, 82, 6163-6171 |
4038137 | CIF | C11 H10 F N O | P c a 21 | 15.8646; 5.3549; 10.5519 90; 90; 90 | 896.42 | Banjare, Shyam Kumar; Biswal, Pragati; Ravikumar, Ponneri Chandrababu Cobalt-Catalyzed One-Step Access to Pyroquilon and C-7 Alkenylation of Indoline with Activated Alkenes Using Weakly Coordinating Functional Group. The Journal of organic chemistry, 2020 |
4027706 | CIF | C11 H10 F10 O5 | P 1 21/c 1 | 5.4658; 17.842; 15.3081 90; 104.041; 90 | 1448.26 | Albrecht Berkessel; Sonja S. Vormittag; Nils E. Schlörer; Jörg-M. Neudörfl TEFDDOLs (α,α,α',α'-Tetrakis(perfluoroaryl/alkyl)-2,2'-dimethyl -1,3-dioxolane-4,5-dimethanols): Highly Fluorinated Chiral H-Bond Donors and Brønsted Acids with Distinct H-Bonding Patterns and Supramolecular Architectures Journal of Organic Chemistry, 2012, 77, 10145-10157 |
4027694 | CIF | C11 H10 F12 O4 | P 21 21 21 | 9.9444; 13.0012; 36.1469 90; 90; 90 | 4673.4 | Albrecht Berkessel; Sonja S. Vormittag; Nils E. Schlörer; Jörg-M. Neudörfl TEFDDOLs (α,α,α',α'-Tetrakis(perfluoroaryl/alkyl)-2,2'-dimethyl -1,3-dioxolane-4,5-dimethanols): Highly Fluorinated Chiral H-Bond Donors and Brønsted Acids with Distinct H-Bonding Patterns and Supramolecular Architectures Journal of Organic Chemistry, 2012, 77, 10145-10157 |
4038749 | CIF | C11 H10 F3 N O | P 1 21/n 1 | 5.1598; 11.2723; 17.688 90; 93.058; 90 | 1027.3 | Chernykh, Anton V.; Olifir, Oleksandr S.; Kuchkovska, Yuliya O.; Volochnyuk, Dmitriy M.; Yarmolchuk, Vladimir S.; Grygorenko, Oleksandr O. Fluoroalkyl-Substituted Cyclopropane Derivatives: Synthesis and Physicochemical Properties. The Journal of organic chemistry, 2020, 85, 12692-12702 |
4038751 | CIF | C11 H10 F3 N O | P b c a | 8.6036; 11.7912; 21.27 90; 90; 90 | 2157.8 | Chernykh, Anton V.; Olifir, Oleksandr S.; Kuchkovska, Yuliya O.; Volochnyuk, Dmitriy M.; Yarmolchuk, Vladimir S.; Grygorenko, Oleksandr O. Fluoroalkyl-Substituted Cyclopropane Derivatives: Synthesis and Physicochemical Properties. The Journal of organic chemistry, 2020, 85, 12692-12702 |
4038227 | CIF | C11 H10 N O3 S | P 1 21/n 1 | 7.7122; 6.9375; 20.1264 90; 94.982; 90 | 1072.76 | Mao, Jialin; Hai, Yu; Ye, Hebo; You, Lei Adaptive Covalent Networks Enabled by Dual Reactivity: The Evolution of Reversible Covalent Bonds, Their Molecular Assemblies, and Guest Recognition. The Journal of organic chemistry, 2020, 85, 5351-5361 |
4025203 | CIF | C11 H10 N2 | P -1 | 7.591; 7.82; 8.966 98.326; 101.303; 116.283 | 451.4 | Glenn A. Burley; David L. Davies; Gerry A. Griffith; Michael Lee; Kuldip Singh Cu-Catalyzed N-Alkynylation of Imidazoles, Benzimidazoles, Indazoles, and Pyrazoles Using PEG as Solvent Medium Journal of Organic Chemistry, 2010, 75, 980-983 |
4028818 | CIF | C11 H10 N2 O | P 1 21/n 1 | 13.4278; 10.9087; 13.4767 90; 99.609; 90 | 1946.4 | Xiaoqing Xin; Dexuan Xiang; Jiming Yang; Qian Zhang; Fenguo Zhou; Dewen Dong Homogeneous and Stereoselective Copper(II)-Catalyzed Monohydration of Methylenemalononitriles to 2-Cyanoacrylamides Journal of Organic Chemistry, 2013, 78, 11956-11961 |
4032899 | CIF | C11 H10 N2 O | P 21 21 21 | 5.608; 8.703; 20.091 90; 90; 90 | 980.6 | Meng, Fei; Zhang, Honglin; Guo, Kang; Dong, Jiayue; Lu, Ai-Min; Zhu, Yingguang Access to Cyano-Containing Isoxazolines via Copper-Catalyzed Domino Cyclization/Cyanation of Alkenyl Oximes. The Journal of organic chemistry, 2017, 82, 10742-10747 |
4034644 | CIF | C11 H10 N2 O | C 1 c 1 | 17.28; 7.0153; 7.3724 90; 102.57; 90 | 872.3 | Wang, Xiaoping; Huang, Danfeng; Wang, Ke-Hu; Su, Yingpeng; Hu, Yulai Tin Powder-Promoted Cascade Condensation/Allylation/Lactamization: Synthesis of Isoindolinones and Pyrazoloisoindol-8-ones. The Journal of organic chemistry, 2019, 84, 6946-6961 |
4023913 | CIF | C11 H10 N2 O2 | P c a 21 | 18.8943; 4.5121; 11.5662 90; 90; 90 | 986.05 | Zhan Zhang; Ji-Young Shin; David Dolphin Facile Synthesis of Unsubstituted β,β'-Linked Diformyldipyrromethanes Journal of Organic Chemistry, 2008, 73, 9515-9517 |
4034741 | CIF | C11 H10 N2 O2 | P 21 21 21 | 6.5102; 10.6554; 14.2094 90; 90; 90 | 985.69 | Li, Chaoran; Yuan, Jingwen; Zhang, Qian; Bhujanga Rao, Chitturi; Zhang, Rui; Zhao, Yanning; Deng, Bicheng; Dong, Dewen Oxidative Cyclization of β-Aminoacrylamides Mediated by PhIO: Chemoselective Synthesis of Isoxazoles and 2 H-Azirines. The Journal of organic chemistry, 2018, 83, 14999-15008 |
4035758 | CIF | C11 H10 N2 O7 | P -1 | 5.383; 11.95; 19.616 89.964; 89.969; 85.193 | 1257 | Islam, Abu Saleh Musha; Bhowmick, Rahul; Chandra Garain, Bidhan; Katarkar, Atul; Ali, Mahammad Nitric Oxide Sensing through 1,2,3,4-Oxatriazole Formation from Acylhydrazide: A Kinetic Study. The Journal of organic chemistry, 2018, 83, 13287-13295 |
4025108 | CIF | C11 H10 N4 | P 1 2/n 1 | 10.9881; 4.3351; 20.561 90; 98.561; 90 | 968.5 | Liyan Xing; Charline Wiegert; Anne Petitjean Stereochemical and Conformational Exchanges inN,N'-Di(2-pyridyl)formamidines: An X-ray and1H NMR Study Journal of Organic Chemistry, 2009, 74, 9513-9516 |
4031864 | CIF | C11 H10 O2 S2 | P 21 21 21 | 7.0792; 10.326; 14.979 90; 90; 90 | 1095 | Picado, Alfredo; Li, ShengJian; Dieter, R. Karl A Serendipitous Synthesis of Bis-Heterocyclic Spiro 3(2H)-Furanones. The Journal of organic chemistry, 2016, 81, 1391-1400 |
4035879 | CIF | C11 H11 Br F3 N O3 | P 21 21 21 | 5.7871; 13.5493; 16.8357 90; 90; 90 | 1320.11 | Martínez-Pardo, Pablo; Blay, Gonzalo; Vila, Carlos; Sanz-Marco, Amparo; Muñoz, M Carmen; Pedro, José R Enantioselective Synthesis of 5-Trifluoromethyl-2-oxazolines under Dual Silver/Organocatalysis. The Journal of organic chemistry, 2019, 84, 314-325 |
4025703 | CIF | C11 H11 Br O3 | P 21 21 21 | 5.68; 8.405; 21.474 90; 90; 90 | 1025.2 | Rachel L. Beingessner; Julie A. Farand; Louis Barriault Progress toward the Total Synthesis of (\±)-Havellockate Journal of Organic Chemistry, 2010, 75, 6337-6346 |
4030931 | CIF | C11 H11 Br O3 | P 1 21/n 1 | 11.7748; 5.8863; 17.0638 90; 110.044; 90 | 1111.06 | Tian, Tian; Li, Liqi; Xue, Jijun; Zhang, Jie; Li, Ying Enantioselective Syntheses of Spiroketals via a Tandem Reaction of Cu(I) -Catalyzed Cycloetherification and H-Bond-induced [4 + 2] Cyclization. The Journal of organic chemistry, 2015, 150407100357003 |
4024240 | CIF | C11 H11 Br S3 Si | P -1 | 8.0503; 9.591; 9.965 85.848; 79.656; 68.223 | 702.9 | Chunli Li; Jianwu Shi; Li Xu; Yangguang Wang; Yanxiang Cheng; Hua Wang Syntheses and Crystal Structures of Fused Thiophenes: [7]Helicene and Double Helicene, a D2-Symmetric Dimer of 3,3'-Bis(dithieno[2,3-b:3',2'-d]thiophene) Journal of Organic Chemistry, 2009, 74, 408-411 |
4028326 | CIF | C11 H11 Br S3 Si | P n m a | 10.271; 7.222; 19.244 90; 90; 90 | 1427 | Huiliang Sun; Jianwu Shi; Zilong Zhang; Sheng Zhang; Zhaoli Liang; Shisheng Wan; Yanxiang Cheng; Hua Wang Synthesis and Structure of Bull's Horn-Shaped Oligothienoacene with Seven Fused Thiophene Rings Journal of Organic Chemistry, 2013, 78, 6271-6275 |
4038225 | CIF | C11 H11 Br2 N O4 | P 1 21/c 1 | 14.974; 6.769; 14.617 90; 117.79; 90 | 1310.7 | Liu, Renzhi; Yang, Min; Xie, Wenlin; Dong, Wenbi; Zhou, Hongwei; Yadav, Sarita; Potkin, Vladimir Ivanovich; Qiu, Guanyinsheng Synthesis of 3-Hydroxyisoindolin-1-ones Through 1, 4-Dioxane-Mediated Hydroxylhydrative aza-Cyclization of 2-Alkynylbenzamide in Water. The Journal of organic chemistry, 2020 |
4035034 | CIF | C11 H11 Cl F3 N O | P 1 21/n 1 | 5.35148; 13.2226; 16.0719 90; 96.9164; 90 | 1128.98 | Golushko, Andrei A.; Sandzhieva, Maria A.; Ivanov, Alexander Yu; Boyarskaya, Irina A.; Khoroshilova, Olesya V.; Barkov, Alexey Yu; Vasilyev, Aleksander V. Reactions of 3,3,3-Trihalogeno-1-nitropropenes with Arenes in the Superacid CF<sub>3</sub>SO<sub>3</sub>H: Synthesis of ( Z)-3,3,3-Trihalogeno-1,2-diarylpropan-1-one Oximes and Study on the Reaction Mechanism. The Journal of organic chemistry, 2018, 83, 10142-10157 |
4026401 | CIF | C11 H11 Cl O3 | P 1 21/n 1 | 7.8322; 11.278; 11.6378 90; 98.353; 90 | 1017.08 | Christopher P. Hencken; Douglas T. Genna; Maxime A. Siegler; Gary H. Posner Highly Stereocontrolled and Regiocontrolled Syntheses of 2,3,4-Trisubstituted Alkanoates and Lactones Journal of Organic Chemistry, 2011, 76, 5149-5155 |
4035766 | CIF | C11 H11 Cl O5 | P 1 21/c 1 | 28.22; 5.8112; 14.3654 90; 104.727; 90 | 2278.4 | Vil', Vera A.; Gomes, Gabriel Dos Passos; Ekimova, Maria V.; Lyssenko, Konstantin A.; Syroeshkin, Mikhail A.; Nikishin, Gennady I.; Alabugin, Igor V.; Terent'ev, Alexander O. Five Roads That Converge at the Cyclic Peroxy-Criegee Intermediates: BF<sub>3</sub>-Catalyzed Synthesis of β-Hydroperoxy-β-peroxylactones. The Journal of organic chemistry, 2018, 83, 13427-13445 |
4028128 | CIF | C11 H11 Cl S | P -1 | 6.946; 7.72; 9.057 90.861; 89.656; 98.724 | 479.99 | Caterina Viglianisi; Lucia Becucci; Cristina Faggi; Sara Piantini; Piero Procacci; Stefano Menichetti Regioselective Electrophilic Access to Naphtho[1,2-b:8,7-b']- and -[1,2-b:5,6-b']dithiophenes Journal of Organic Chemistry, 2013, 78, 3496-3502 |
4028129 | CIF | C11 H11 Cl S | P -1 | 5.291; 7.714; 12.239 99.618; 94.426; 102.384 | 477.73 | Caterina Viglianisi; Lucia Becucci; Cristina Faggi; Sara Piantini; Piero Procacci; Stefano Menichetti Regioselective Electrophilic Access to Naphtho[1,2-b:8,7-b']- and -[1,2-b:5,6-b']dithiophenes Journal of Organic Chemistry, 2013, 78, 3496-3502 |
4021849 | CIF | C11 H11 Cl2 N O2 | P 1 21/n 1 | 8.6303; 7.5224; 17.1285 90; 98.932; 90 | 1098.51 | Yugang Chen; Mark G. Steinmetz Photoactivation of Amino-Substituted 1,4-Benzoquinones for Release of Carboxylate and Phenolate Leaving Groups Using Visible Light Journal of Organic Chemistry, 2006, 71, 6053-6060 |
4035155 | CIF | C11 H11 Cl2 N O2 | P 1 21/c 1 | 7.4007; 21.7382; 7.488 90; 105.323; 90 | 1161.8 | Bisz, Elwira; Piontek, Aleksandara; Dziuk, Błażej; Szostak, Roman; Szostak, Michal Barriers to Rotation in ortho-Substituted Tertiary Aromatic Amides: Effect of Chloro-Substitution on Resonance and Distortion. The Journal of organic chemistry, 2018, 83, 3159-3163 |
4036272 | CIF | C11 H11 Cl4 N O2 | P 1 21/n 1 | 10.143; 14.482; 10.4728 90; 114.874; 90 | 1395.7 | Sharma, Shikha; Rajale, Trideep; Unruh, Daniel K.; Birney, David M. Competitive Pseudopericyclic [3,3]- and [3,5]-Sigmatropic Rearrangements of Trichloroacetimidates. The Journal of organic chemistry, 2015, 80, 11734-11743 |
4025627 | CIF HKL | C11 H11 F O3 S | P 1 21/c 1 | 6.584; 8.35; 20.276 90; 91.51; 90 | 1114.3 | Florenci V. González; Amit Jain; Santiago Rodríguez; José A. Sáez; Cristian Vicent; Gabriel Peris Stereoisomerization of β-Hydroxy-α-sulfenyl-γ-butyrolactones Controlled by Two Concomitant 1,4-Type Nonbonded Sulfur-Oxygen Interactions As Analyzed by X-ray Crystallography Journal of Organic Chemistry, 2010, 75, 5888-5894 |
4035285 | CIF | C11 H11 F2 N O | P 21 21 21 | 8.7532; 9.7766; 11.3827 90; 90; 90 | 974.09 | Xi, Ning; Sun, Xiaohua; Li, Minxiong; Sun, Mingming; Xi, Michael A.; Zhan, Zeping; Yao, Jia; Bai, Xu; Wu, Yanjun; Liao, Min Noncovalent Interactions of Fluorine with Amide and CH<sub>2</sub> Groups in N-Phenyl γ-Lactams: Covalently Identical Fluorine Atoms in Nonequivalent Chemical Environments. The Journal of organic chemistry, 2018, 83, 11586-11594 |
4032036 | CIF | C11 H11 F5 O3 S | P -1 | 8.4711; 8.8607; 8.9602 99.478; 110.838; 95.682 | 610.85 | Ponomarenko, Maksym V.; Grabowsky, Simon; Pal, Rumpa; Röschenthaler, Gerd-Volker; Fokin, Andrey A. SF5-Enolates in Ti(IV)-Mediated Aldol Reactions. The Journal of organic chemistry, 2016, 81, 6783-6791 |
4024132 | CIF | C11 H11 F6 N O4 S2 | P 1 21/c 1 | 12.407; 8.095; 15.533 90; 95.256; 90 | 1553.6 | Kenneth K. Laali; Takao Okazaki; Scott D. Bunge N-(Trifluoromethylsulfonyl)aryloxytrifluoromethylsulfoximines [ArO-SO(CF~3~)=NTf and N-Aryltriflimides Ar-N(Tf)~2~ by Thermal and Photolytic Dediazoniation of [ArN~2~][BF~4~] in [BMIM][Tf~2~N] Ionic Liquid: Exploiting the Ambident Nucleophilic Character of a "Nonnucleophilic" Anion Journal of Organic Chemistry, 2007, 72, 6758-6762 |
4032522 | CIF | C11 H11 I N2 | P b c a | 16.3855; 7.3631; 18.7465 90; 90; 90 | 2261.73 | Beyeh, Ngong Kodiah; Jo, Hyun Hwa; Kolesnichenko, Igor; Pan, Fangfang; Kalenius, Elina; Anslyn, Eric V.; Ras, Robin H. A.; Rissanen, Kari Recognition of Viologen Derivatives in Water by N-Alkyl Ammonium Resorcinarene Chlorides. The Journal of organic chemistry, 2017, 82, 5198-5203 |
4035027 | CIF | C11 H11 I2 N O | P 1 21/n 1 | 6.0555; 10.5535; 19.4333 90; 98.716; 90 | 1227.58 | Zhu, Yu; Shao, Li-Dong; Deng, Zhen-Tao; Bao, Ying; Shi, Xin; Zhao, Qin-Shi PIDA/I<sub>2</sub>-Mediated α- and β-C(sp<sup>3</sup>)-H Bond Dual Functionalization of Tertiary Amines. The Journal of organic chemistry, 2018, 83, 10166-10174 |
4027565 | CIF | C11 H11 N O | P 1 21/n 1 | 8.2964; 11.3994; 9.5886 90; 90.87; 90 | 906.73 | Benjamin J. Pollock; Christos A. Sikes; Ryan P. Ter Louw; Scott R. Hawken; Amy L. Speelman; Eugene J. Lynch; Daniel J. Stanford; Kraig A. Wheeler; Jason G. Gillmore Synthesis and Structural Investigation of an "Oxazinoquinolinespirohexadienone" That Only Exists as Its Long-Wavelength Ring-Opened Quinonimine Isomer Journal of Organic Chemistry, 2012, 77, 8689-8695 |
4028863 | CIF | C11 H11 N O | P 1 21/n 1 | 8.7086; 5.7304; 17.984 90; 101.455; 90 | 879.59 | Naoki Kise; Yusuke Kawano; Toshihiko Sakurai Reductive Coupling of Phthalimides with Ketones and Aldehydes by Low-Valent Titanium: One-Pot Synthesis of Alkylideneisoindolin-1-ones Journal of Organic Chemistry, 2013, 78, 12453-12459 |
4022751 | CIF | C11 H11 N O2 | P b c a | 7.4907; 13.1495; 18.5332 90; 90; 90 | 1825.5 | Philip J. Parsons; Alexander J. Waters; Daryl S. Walter; Johnathan Board A New Route to Highly Functionalized Heterocyclic Rings Journal of Organic Chemistry, 2007, 72, 1395-1398 |
4036671 | CIF | C11 H11 N O2 | P 1 21/n 1 | 4.7994; 13.7192; 13.8234 90; 95.721; 90 | 905.65 | Li, Xing Guang; Sun, Min; Jin, Qiao; Liu, Kai; Liu, Pei Nian Access to Isoquinolines and Isoquinolin-3-ols via Rh(III)-Catalyzed Coupling/Cyclization Cascade Reaction of Arylimidates and Diazo Compounds. The Journal of organic chemistry, 2016, 81, 3901-3910 |
4035512 | CIF | C11 H11 N O3 | P 1 21/n 1 | 7.3288; 16.8413; 8.2232 90; 101.669; 90 | 993.98 | Baumann, Andreas N.; Schüppel, Franziska; Eisold, Michael; Kreppel, Andrea; de Vivie-Riedle, Regina; Didier, Dorian Oxidative Ring Contraction of Cyclobutenes: General Approach to Cyclopropylketones including Mechanistic Insights. The Journal of organic chemistry, 2018, 83, 4905-4921 |
4025984 | CIF | C11 H11 N O4 | P 1 21 1 | 8.2984; 5.8941; 11.0767 90; 108.428; 90 | 514 | Lawrence Harris; Simon P. H. Mee; Richard H. Furneaux; Graeme J. Gainsford; Andreas Luxenburger Alkyl 4-Chlorobenzoyloxycarbamates as Highly Effective Nitrogen Source Reagents for the Base-Free, Intermolecular Aminohydroxylation Reaction Journal of Organic Chemistry, 2011, 76, 358-372 |
4033314 | CIF | C11 H11 N O4 S2 | P 1 21 1 | 6.5955; 10.6686; 17.0119 90; 90.016; 90 | 1197.04 | Yoshimura, Akira; Nguyen, Khiem C.; Rohde, Gregory T.; Postnikov, Pavel S.; Yusubov, Mekhman S.; Zhdankin, Viktor V. Hypervalent Iodine Reagent Mediated Oxidative Heterocyclization of Aldoximes with Heterocyclic Alkenes. The Journal of organic chemistry, 2017, 82, 11742-11751 |
4020604 | CIF | C11 H11 N O5 | P 1 21/n 1 | 7.1832; 11.6551; 13.933 90; 100.988; 90 | 1145.1 | Liwen He; G. S. C. Srikanth; Steven L. Castle Synthesis of β-Substituted α-Amino Acids via Lewis Acid Promoted Enantioselective Radical Conjugate Additions Journal of Organic Chemistry, 2005, 70, 8140-8147 |
4023416 | CIF | C11 H11 N O5 | P 1 21 1 | 6.065; 5.9654; 14.695 90; 91.142; 90 | 531.55 | Saumen Hajra; Aswini Kumar Giri Organocatalytic and Enantioselective Synthesis of β-(Hydroxyalkyl)-γ-Butyrolactones Journal of Organic Chemistry, 2008, 73, 3935-3937 |
4037605 | CIF | C11 H11 N O6 | C 1 c 1 | 4.3177; 16.1033; 15.9891 90; 94.126; 90 | 1108.83 | Kaur, Divneet; Luk, Hoi L.; Coldren, William; Srinivas, Pavan M.; Sridhar, Lakshetti; Prabhakar, Sripadi; Raghunathan, Partha; Guru Row, T. N.; Hadad, Christopher M.; Platz, Matthew S.; Eswaran, Sambasivan V. Concomitant nitrene and carbene insertion accompanying ring expansion: spectroscopic, X-ray, and computational studies. The Journal of organic chemistry, 2014, 79, 1199-1205 |
4030559 | CIF | C11 H11 N3 | P b c a | 9.8175; 10.663; 18.25 90; 90; 90 | 1910.5 | Xu, Hao; Ma, Shuang; Xu, Yuanqing; Bian, Longxiang; Ding, Tao; Fang, Xiaomin; Zhang, Wenkai; Ren, Yanrong Copper-catalyzed one-pot synthesis of 1,2,4-triazoles from nitriles and hydroxylamine. The Journal of organic chemistry, 2015, 80, 1789-1794 |
4032558 | CIF | C11 H11 N3 | P 1 21/c 1 | 8.032; 6.421; 19.345 90; 96.34; 90 | 991.6 | Peterson, Joshua P.; Geraskina, Margarita R.; Zhang, Rui; Winter, Arthur H. Effect of Substituents on the Bond Strength of Air-Stable Dicyanomethyl Radical Thermochromes. The Journal of organic chemistry, 2017, 82, 6497-6501 |
4027064 | CIF | C11 H11 N3 O | P 1 21/n 1 | 5.80481; 14.0954; 11.0624 90; 93.634; 90 | 903.32 | Ping Yin; Nan Liu; Yu-Xing Deng; Yue Chen; Yong Deng; Ling He Synthesis of 2,4-Diaminoquinazolines and Tricyclic Quinazolines by Cascade Reductive Cyclization of Methyl N-Cyano-2-nitrobenzimidates Journal of Organic Chemistry, 2012, 77, 2649-2658 |
4029933 | CIF | C11 H11 N3 O | P b c a | 19.096; 8.8874; 24.908 90; 90; 90 | 4227.2 | Rajam, Sridhar; Jadhav, Abhijit V.; Li, Qian; Sarkar, Sujan K.; Singh, Pradeep N. D.; Rohr, Ahleah; Pace, Tamara C. S.; Li, Rui; Krause, Jeanette A.; Bohne, Cornelia; Ault, Bruce S.; Gudmundsdottir, Anna D. Triplet sensitized photolysis of a vinyl azide: direct detection of a triplet vinyl azide and nitrene. The Journal of organic chemistry, 2014, 79, 9325-9334 |
4024028 | CIF | C11 H11 N3 O2 | F d d 2 | 18.987; 24.295; 9.2123 90; 90; 90 | 4249.6 | Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport Enols of Substituted Cyanomalonamides Journal of Organic Chemistry, 2007, 72, 5297-5312 |
4032790 | CIF | C11 H11 N3 O2 | P b c a | 11.0134; 9.5835; 19.539 90; 90; 90 | 2062.28 | Huang, Adrian; Wo, Kellie; Lee, So Yeun Christine; Kneitschel, Nika; Chang, Jennifer; Zhu, Kathleen; Mello, Tatsiana; Bancroft, Laura; Norman, Natalie J.; Zheng, Shao-Liang Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles. The Journal of organic chemistry, 2017, 82, 8864-8872 |
4021179 | CIF | C11 H11 N3 O3 | P 1 21/c 1 | 8.8931; 11.851; 10.408 90; 97.25; 90 | 1088.2 | Per Wiklund; Mark Rogers-Evans; Jan Bergman Synthesis of 1,4-Benzodiazepine-3,5-diones Journal of Organic Chemistry, 2004, 69, 6371-6376 |
4022443 | CIF | C11 H11 N3 S2 | P -1 | 6.6652; 8.1833; 11.246 83.311; 77.601; 69.863 | 561.86 | Franciszek Sączewski; Jarosław Sączewski; Maria Gdaniec Synthesis, Molecular Structure, and Applications of 2-Hydroxylamino-4,5-dihydroimidazolium-O-sulfonate to the Synthesis of Novel Heterocyclic Ring Systems Journal of Organic Chemistry, 2003, 68, 4791-4796 |
4025877 | CIF | C11 H11 N7 O S | P -1 | 5.6144; 10.0973; 11.4889 79.041; 80.182; 86.428 | 629.77 | Sergey L. Deev; Zakhar O. Shenkarev; Tatyana S. Shestakova; Oleg N. Chupakhin; Vladimir L. Rusinov; Alexander S. Arseniev Selective 15N-Labeling and Analysis of 13C-15N J Couplings as an Effective Tool for Studying the Structure and Azide-Tetrazole Equilibrium in a Series of Tetrazolo[1,5-b][1,2,4]triazines and Tetrazolo[1,5-a]pyrimidines Journal of Organic Chemistry, 2010, 75, 8487-8497 |
4024389 | CIF | C11 H12 Br3 N O4 | P 1 21/n 1 | 10.433; 11.751; 12.122 90; 91.12; 90 | 1486 | Bichismita Sahu; Guddeangadi N. Gururaja; Shaikh M. Mobin; Irishi N. N. Namboothiri Facile Synthesis of β-Tribromomethyl and Dibromomethylenated Nitroalkanes via Conjugate Addition of Bromoform to Nitroalkenes Journal of Organic Chemistry, 2009, 74, 2601-2604 |
4035153 | CIF | C11 H12 Cl N O2 | P 31 | 9.9808; 9.9808; 9.5853 90; 90; 120 | 826.93 | Bisz, Elwira; Piontek, Aleksandara; Dziuk, Błażej; Szostak, Roman; Szostak, Michal Barriers to Rotation in ortho-Substituted Tertiary Aromatic Amides: Effect of Chloro-Substitution on Resonance and Distortion. The Journal of organic chemistry, 2018, 83, 3159-3163 |
4035154 | CIF | C11 H12 Cl N O2 | P 1 21/c 1 | 10.4408; 7.517; 14.8019 90; 110.65; 90 | 1087.07 | Bisz, Elwira; Piontek, Aleksandara; Dziuk, Błażej; Szostak, Roman; Szostak, Michal Barriers to Rotation in ortho-Substituted Tertiary Aromatic Amides: Effect of Chloro-Substitution on Resonance and Distortion. The Journal of organic chemistry, 2018, 83, 3159-3163 |
4036858 | CIF | C11 H12 Cl N O3 | P -1 | 6.903; 8.862; 9.524 74.756; 84.1; 82.37 | 555.7 | Liu, Gong-Qing; Cui, Bin; Xu, Rong; Li, Yue-Ming Preparation of trans-2-Substituted-4-halopiperidines and cis-2-Substituted-4-halotetrahydropyrans via AlCl3-Catalyzed Prins Reaction. The Journal of organic chemistry, 2016, 81, 5144-5161 |
4029587 | CIF | C11 H12 Cl N3 O | P -1 | 28.311; 10.0361; 8.1588 90; 90; 90 | 2318.2 | Mishra, Kunj B.; Tiwari, Vinod K. Click chemistry inspired synthesis of morpholine-fused triazoles. The Journal of organic chemistry, 2014, 79, 5752-5762 |
4023689 | CIF | C11 H12 Cl2 O5 S | P 1 21/c 1 | 6.6343; 20.9581; 10.626 90; 102.039; 90 | 1445 | Jarrod W. Johnson; Darryl P. Evanoff; Marc E. Savard; Gerald Lange; Timothy R. Ramadhar; Abdeljalil Assoud; Nicholas J. Taylor; Gary I. Dmitrienko Cyclobutanone Mimics of Penicillins: Effects of Substitution on Conformation and Hemiketal Stability Journal of Organic Chemistry, 2008, 73, 6970-6982 |
4036271 | CIF | C11 H12 Cl3 N O2 | P c c n | 14.3724; 15.465; 11.7888 90; 90; 90 | 2620.3 | Sharma, Shikha; Rajale, Trideep; Unruh, Daniel K.; Birney, David M. Competitive Pseudopericyclic [3,3]- and [3,5]-Sigmatropic Rearrangements of Trichloroacetimidates. The Journal of organic chemistry, 2015, 80, 11734-11743 |
4027556 | CIF | C11 H12 Cl3 N O3 | P 1 21/a 1 | 10.5574; 11.1904; 12.0818 90; 104.971; 90 | 1378.91 | Masruri; Anthony C. Willis; Malcolm D. McLeod Osmium-Catalyzed Vicinal Oxyamination of Alkenes by N-(4-Toluenesulfonyloxy)carbamates Journal of Organic Chemistry, 2012, 77, 8480-8491 |
4027558 | CIF | C11 H12 Cl3 N O3 | P -1 | 6.5153; 9.6632; 11.5125 88.8571; 77.467; 85.8 | 705.63 | Masruri; Anthony C. Willis; Malcolm D. McLeod Osmium-Catalyzed Vicinal Oxyamination of Alkenes by N-(4-Toluenesulfonyloxy)carbamates Journal of Organic Chemistry, 2012, 77, 8480-8491 |
4028191 | CIF | C11 H12 F3 N O2 | P 1 21 1 | 8.247; 5.0946; 14.235 90; 100.136; 90 | 588.8 | Haizhen Jiang; Liuming Yan; Minjun Xu; Wenjun Lu; Yeshan Cai; Wen Wan; Jianhua Yao; Shaoxiong Wu; Shizheng Zhu; Jian Hao Nucleophile-Dependent Regioselective Reaction of (S)-4-Benzyl-2-Fluoroalkyl-1,3-Oxazolines Journal of Organic Chemistry, 2013, 78, 4261-4269 |
4034777 | CIF | C11 H12 F3 N O2 S | P b c a | 10.8054; 7.8126; 28.528 90; 90; 90 | 2408.3 | Wang, Xue-Juan; Su, Yan; Li, Rui; Gu, Peiming Tf<sub>2</sub>O-Promoted Intramolecular Schmidt Reaction of the ω-Azido Carboxylic Acids. The Journal of organic chemistry, 2018, 83, 5816-5824 |
4036976 | CIF | C11 H12 I N O | P 1 21/c 1 | 12.096; 11.34; 7.9095 90; 92.061; 90 | 1084.23 | Chisholm, David R.; Valentine, Roy; Pohl, Ehmke; Whiting, Andrew Conjugate Addition of 3-Buytn-2-one to Anilines in Ethanol: Alkene Geometric Insights through In Situ FTIR Monitoring. The Journal of organic chemistry, 2016, 81, 7557-7565 |
4036407 | CIF | C11 H12 I N O2 | P b c a | 15.334; 6.3606; 23.307 90; 90; 90 | 2273.2 | Liu, Gong-Qing; Yang, Chun-Hua; Li, Yue-Ming Modular Preparation of 5-Halomethyl-2-oxazolines via PhI(OAc)2-Promoted Intramolecular Halooxygenation of N-Allylcarboxamides. The Journal of organic chemistry, 2015, 80, 11339-11350 |
4023664 | CIF | C11 H12 I N3 O2 S2 | P 21 21 21 | 13.272; 15.108; 15.194 90; 90; 90 | 3046.6 | Prosper Nshimyumukiz; Olivier Fasbender; Bernard Tinant; Jacqueline Marchand-Brynaert; Francis Darro; Raphaël Robiette Divergent and Regioselective Synthesis of 1,2,4- and 1,2,5-Trisubstituted Imidazoles Journal of Organic Chemistry, 2008, 73, 6816-6823 |
4030583 | CIF | C11 H12 N2 O2 | P -1 | 6.9967; 8.5345; 9.7334 110.752; 94.833; 106.902 | 508.51 | Guthrie, Daryl A.; Ho, Anthony; Takahashi, Cyrus G.; Collins, Anthony; Morris, Matthew; Toscano, John P. "Catch-and-Release" of HNO with Pyrazolones. The Journal of organic chemistry, 2015, 80, 1338-1348 |
4023884 | CIF | C11 H12 N2 O2 S | P 1 21/c 1 | 6.5884; 22.658; 7.8877 90; 108.06; 90 | 1119.5 | Tetsuharu Hori; Yuko Otani; Masatoshi Kawahata; Kentaro Yamaguchi; Tomohiko Ohwada Nonplanar Structures of Thioamides Derived from 7-Azabicyclo[2.2.1]heptane. Electronically Tunable Planarity of Thioamides Journal of Organic Chemistry, 2008, 73, 9102-9108 |
4023232 | CIF | C11 H12 N2 O3 | P 1 21/n 1 | 9.4397; 11.6437; 9.704 90; 104.825; 90 | 1031.1 | José Luis García Ruano; Teresa de Haro; Rajinder Singh; M. Belén Cid An Efficient Method for the Synthesis of Nitropiperidones Journal of Organic Chemistry, 2008, 73, 1150-1153 |
4025612 | CIF | C11 H12 N2 O3 | P 1 21/c 1 | 6.2542; 15.983; 10.437 90; 92.812; 90 | 1042.04 | Marcus Angelin; Martin Rahm; Andreas Fischer; Tore Brinck; Olof Ramström Diastereoselective One-Pot Tandem Synthesis of 3-Substituted Isoindolinones: A Mechanistic Investigation Journal of Organic Chemistry, 2010, 75, 5882-5887 |
4025613 | CIF | C11 H12 N2 O3 | R -3 :H | 35.53; 35.53; 5.4355 90; 90; 120 | 5942.4 | Marcus Angelin; Martin Rahm; Andreas Fischer; Tore Brinck; Olof Ramström Diastereoselective One-Pot Tandem Synthesis of 3-Substituted Isoindolinones: A Mechanistic Investigation Journal of Organic Chemistry, 2010, 75, 5882-5887 |
4034465 | CIF | C11 H12 N2 O5 | P 1 21/c 1 | 9.4352; 8.4152; 14.7368 90; 97.276; 90 | 1160.7 | Martin, Daniel J.; Mercado, Brandon Q.; Mayer, James M. Synthesis and Prior Misidentification of 4-<i>tert</i>-Butyl-2,6-dinitrobenzaldehyde. The Journal of organic chemistry, 2019, 84, 12172-12176 |
4034466 | CIF | C11 H12 N2 O5 | P 1 21/c 1 | 18.7889; 10.5423; 11.6936 90; 91.857; 90 | 2315 | Martin, Daniel J.; Mercado, Brandon Q.; Mayer, James M. Synthesis and Prior Misidentification of 4-<i>tert</i>-Butyl-2,6-dinitrobenzaldehyde. The Journal of organic chemistry, 2019, 84, 12172-12176 |
4038774 | CIF | C11 H12 N2 S | P -1 | 6.5847; 8.4285; 9.4274 89.0396; 72.6274; 80.7426 | 492.57 | Geng, Xinyu; Liu, Siyuan; Wang, Wenyao; Qu, Jingping; Wang, Baomin <i>tert</i>-Amino Effect-Promoted Rearrangement of Aryl Isothiocyanate: A Versatile Approach to Benzimidazothiazepines and Benzimidazothioethers. The Journal of organic chemistry, 2020, 85, 12635-12643 |
4033678 | CIF | C11 H12 N4 O | P 1 21/n 1 | 3.9963; 11.3522; 22.1872 90; 93.619; 90 | 1004.55 | Bodzioch, Agnieszka; Pomikło, Dominika; Celeda, Małgorzata; Pietrzak, Anna; Kaszyński, Piotr 3-Substituted Benzo[ e][1,2,4]triazines: Synthesis and Electronic Effects of the C(3) Substituent. The Journal of organic chemistry, 2019, 84, 6377-6394 |
4029616 | CIF | C11 H12 N4 O2 S | P 1 21/c 1 | 19.3293; 4.6077; 14.1682 90; 110.229; 90 | 1184.04 | Dürüst, Yaşar; Sağırlı, Akın Microwave-Assisted Coupling Reaction of N-Aryl Sydnones with 2-Nitromethylenethiazolidine: Unexpected Formation of (Z)-2-(Nitro((E)-p-substitutedphenyldiazenyl)methylene)thiazolidines. The Journal of organic chemistry, 2014, 79, 6380-6384 |
4033859 | CIF | C11 H12 N6 O2 S | P 1 21/c 1 | 13.2992; 9.3014; 11.1624 90; 107.772; 90 | 1314.91 | Yang, Hongwei; Huang, Liping; Xu, Minxian; Tang, Yongxing; Wang, Bohan; Cheng, Guangbin Strategy for Extending the Nitrogen Chain: The Bis(1,2,3-triazole) Formation Reaction from Tosylhydrazones and <i>N</i>-Amino Azole. The Journal of organic chemistry, 2019, 84, 10629-10634 |
4024705 | CIF | C11 H12 O2 | P n a 21 | 17.335; 7.6229; 13.737 90; 90; 90 | 1815.3 | N. N. Bhuvan Kumar; M. Nagarjuna Reddy; K. C. Kumara Swamy Reactivity of Allenylphosphonates toward Salicylaldehydes and Activated Phenols: Facile Synthesis of Chromenes and Substituted Butadienes Journal of Organic Chemistry, 2009, 74, 5395-5404 |
4034117 | CIF | C11 H12 O2 | C 1 2/c 1 | 15.4514; 7.7992; 7.9194 90; 93.005; 90 | 953.04 | Kaleta, Jiří; Bastien, Guillaume; Wen, Jin; Dračínský, Martin; Tortorici, Edward; Císařová, Ivana; Beale, Paul D.; Rogers, Charles T.; Michl, Josef Bulk Inclusions of Double Pyridazine Molecular Rotors in Hexagonal Tris( o-phenylene)cyclotriphosphazene. The Journal of organic chemistry, 2019, 84, 8449-8467 |
4027029 | CIF | C11 H12 O3 | P 1 21 1 | 10.1592; 6.5759; 14.314 90; 92.95; 90 | 955 | Ulf Scheffler; Rainer Mahrwald Histidine-Catalyzed Asymmetric Aldol Addition of Enolizable Aldehydes: Insights into its Mechanism Journal of Organic Chemistry, 2012, 77, 2310-2330 |
4032649 | CIF | C11 H12 O3 | P 21 21 21 | 7.4666; 12.0831; 10.8645 90; 90; 90 | 980.19 | Yan, Qiao; Bolte, Benoit; Bai, Yuhua; Banwell, Martin G.; Willis, Anthony C.; Carr, Paul D. Studies on the Photochemical Rearrangements of Enantiomerically Pure, Polysubstituted, and Variously Annulated Bicyclo[2.2.2]octenones. The Journal of organic chemistry, 2017, 82, 8008-8022 |
4032663 | CIF | C11 H12 O3 | P 1 21 1 | 8.4949; 5.9702; 9.384 90; 95.383; 90 | 473.82 | Yan, Qiao; Bolte, Benoit; Bai, Yuhua; Banwell, Martin G.; Willis, Anthony C.; Carr, Paul D. Studies on the Photochemical Rearrangements of Enantiomerically Pure, Polysubstituted, and Variously Annulated Bicyclo[2.2.2]octenones. The Journal of organic chemistry, 2017, 82, 8008-8022 |
4032665 | CIF | C11 H12 O3 | P 1 21 1 | 6.9303; 7.7696; 8.6272 90; 92.403; 90 | 464.13 | Yan, Qiao; Bolte, Benoit; Bai, Yuhua; Banwell, Martin G.; Willis, Anthony C.; Carr, Paul D. Studies on the Photochemical Rearrangements of Enantiomerically Pure, Polysubstituted, and Variously Annulated Bicyclo[2.2.2]octenones. The Journal of organic chemistry, 2017, 82, 8008-8022 |
4025624 | CIF | C11 H12 O3 S | P 1 21/c 1 | 6.5804; 8.36; 19.89 90; 91.982; 90 | 1093.5 | Florenci V. González; Amit Jain; Santiago Rodríguez; José A. Sáez; Cristian Vicent; Gabriel Peris Stereoisomerization of β-Hydroxy-α-sulfenyl-γ-butyrolactones Controlled by Two Concomitant 1,4-Type Nonbonded Sulfur-Oxygen Interactions As Analyzed by X-ray Crystallography Journal of Organic Chemistry, 2010, 75, 5888-5894 |
4029912 | CIF | C11 H12 O4 | P -1 | 7.0387; 8.9608; 9.3606 111.215; 102.239; 107.014 | 491.7 | Yao, Hongliang; Song, Liyan; Liu, Yuan; Tong, Rongbiao Cascade Michael Addition/Cycloketalization of Cyclic 1,3-Dicarbonyl Compounds: Important Role of the Tethered Alcohol of α,β-Unsaturated Carbonyl Compounds on Reaction Rate and Regioselectivity. The Journal of organic chemistry, 2014, 79, 8774-8785 |
4035765 | CIF | C11 H12 O5 | P 1 21/c 1 | 26.219; 5.8096; 14.123 90; 105.602; 90 | 2072 | Vil', Vera A.; Gomes, Gabriel Dos Passos; Ekimova, Maria V.; Lyssenko, Konstantin A.; Syroeshkin, Mikhail A.; Nikishin, Gennady I.; Alabugin, Igor V.; Terent'ev, Alexander O. Five Roads That Converge at the Cyclic Peroxy-Criegee Intermediates: BF<sub>3</sub>-Catalyzed Synthesis of β-Hydroperoxy-β-peroxylactones. The Journal of organic chemistry, 2018, 83, 13427-13445 |
4031921 | CIF | C11 H13 Br Cl N | P c a n | 5.4944; 17.8095; 23.213 90; 90; 90 | 2271.5 | Durel, Vianney; Lalli, Claudia; Roisnel, Thierry; Weghe, Pierre van de Synergistic Effect of the TiCl4/p-TsOH Promoter System on the Aza-Prins Cyclization. The Journal of organic chemistry, 2016, 81, 849-859 |
4033017 | CIF | C11 H13 Br Cl N S | P 1 21 1 | 6.823; 26.0046; 7.2754 90; 107.175; 90 | 1233.31 | Parker, Patrick D.; Lemercier, Bérénice C.; Pierce, Joshua G. Synthesis of Quaternary-Substituted Thiazolines via Halocyclization of S-Allyl Thioimidate Salts The Journal of Organic Chemistry, 2017 |
4024777 | CIF | C11 H13 Br N2 O | P 1 21 1 | 7.3048; 8.26; 9.2431 90; 92.177; 90 | 557.3 | Dong-Hui Leng; De-Xiang Wang; Jie Pan; Zhi-Tang Huang; Mei-Xiang Wang Highly Efficient and Enantioselective Biotransformations of Racemic Azetidine-2-carbonitriles and Their Synthetic Applications Journal of Organic Chemistry, 2009, 74, 6077-6082 |
4023503 | CIF | C11 H13 Br O3 | P 1 21/n 1 | 8.0877; 7.3634; 37.9309 90; 94.7722; 90 | 2251.07 | Serena J. Eade; Magnus W. Walter; Colin Byrne; Barbara Odell; Raphaël Rodriguez; Jack E. Baldwin; Robert M.Adlington; John E. Moses Biomimetic Synthesis of Pyrone-Derived Natural Products: Exploring Chemical Pathways from a Unique Polyketide Precursor Journal of Organic Chemistry, 2008, 73, 4830-4839 |
4033928 | CIF | C11 H13 Cl N2 O2 | P n m a | 17.2486; 10.17867; 6.17147 90; 90; 90 | 1083.51 | Ebule, Rene; Mudshinge, Sagar; Nantz, Michael H.; Mashuta, Mark S.; Hammond, Gerald B.; Xu, Bo A 5 + 1 Protic Acid Assisted Aza-Pummerer Approach for Synthesis of 4-Chloropiperidines from Homoallylic Amines. The Journal of organic chemistry, 2019, 84, 3249-3259 |
4029362 | CIF | C11 H13 Cl N2 O5 S | P -1 | 7.3876; 9.7133; 10.4673 103.383; 104.427; 104.585 | 668.4 | Zhou, Jing; Yeung, Ying-Yeung Synthesis of Reboxetine Intermediate and Carnitine Acetyltransferase Inhibitor via NBS-Induced Electrophilic Multicomponent Reaction. The Journal of organic chemistry, 2014, 79, 4644-4649 |
4033650 | CIF | C11 H13 Cl N4 O3 Se | P 21 21 21 | 7.5314; 7.9755; 22.8076 90; 90; 90 | 1369.98 | Lee, Hyejin; Jarhad, Dnyandev B.; Yu, Jinha; Lee, Choongho; Jeong, Lak Shin Asymmetric Synthesis of 2'-<i>C</i>-Methyl-4'-selenonucleosides as Anti-Hepatitis C Virus Agents. The Journal of organic chemistry, 2019 |
4034577 | CIF | C11 H13 Cl O3 | P 1 21/n 1 | 14.851; 4.703; 16.195 90; 107.694; 90 | 1077.6 | Al-Smadi, Derar; Enugala, Thilak Reddy; Kessler, Vadim; Mhashal, Anil Ranu; Lynn Kamerlin, Shina Caroline; Kihlberg, Jan; Norberg, Thomas; Widersten, Mikael Chemical and Biochemical Approaches for the Synthesis of Substituted Dihydroxybutanones and Di- and Tri-Hydroxypentanones. The Journal of organic chemistry, 2019, 84, 6982-6991 |
4030611 | CIF | C11 H13 F N2 O5 | P -1 | 7.235; 7.7188; 10.6228 92.941; 94.611; 102.675 | 575.45 | Clarkson, Rob; Komsta, Zofia; Mayes, Benjamin A.; Moussa, Adel; Shelbourne, Montserrat; Stewart, Alistair; Tyrrell, Andrew J.; Wallis, Laura L.; Weymouth-Wilson, Alexander C Synthesis of 2,3-Dideoxy-2-fluoro-2,3-endo-methylene- and 2,3-Dideoxy-2-fluoro-3-C-hydroxymethyl-2,3-endo-methylene-pentofuranoses and Their Use in the Preparation of Conformationally Locked Bicyclic Nucleosides. The Journal of organic chemistry, 2015, 80, 2198-2215 |
4031073 | CIF | C11 H13 N | P 1 21/c 1 | 6.3432; 11.6806; 11.8916 90; 97.09; 90 | 874.34 | Bremer, Matthias; Untenecker, Harald; Gunchenko, Pavel A.; Fokin, Andrey A.; Schreiner, Peter R. Inverted Carbon Geometries: Challenges to Experiment and Theory. The Journal of organic chemistry, 2015, 80, 6520-6524 |
4035846 | CIF | C11 H13 N | P b c a | 10.874; 8.3249; 19.94 90; 90; 90 | 1805.1 | Skalenko, Yevhen A.; Druzhenko, Tetiana V.; Denisenko, Aleksandr V.; Samoilenko, Maryna V.; Dacenko, Oleksandr P.; Trofymchuk, Serhii A.; Grygorenko, Oleksandr O.; Tolmachev, Andrey A.; Mykhailiuk, Pavel K. [2+2]-Photocycloaddition of N-Benzylmaleimide to Alkenes As an Approach to Functional 3-Azabicyclo[3.2.0]heptanes. The Journal of organic chemistry, 2018, 83, 6275-6289 |
4027677 | CIF | C11 H13 N O | P 1 21/c 1 | 13.1243; 4.763; 15.8937 90; 111.415; 90 | 924.94 | Agnieszka Witosińska; Bogdan Musielak; Paweł Serda; Maria Owińska; Barbara Rys Conformation of Eight-Membered Benzoannulated Lactams by Combined NMR and DFT Studies Journal of Organic Chemistry, 2012, 77, 9784-9794 |
4027678 | CIF | C11 H13 N O | P b c a | 7.4984; 9.8472; 25.9083 90; 90; 90 | 1913.02 | Agnieszka Witosińska; Bogdan Musielak; Paweł Serda; Maria Owińska; Barbara Rys Conformation of Eight-Membered Benzoannulated Lactams by Combined NMR and DFT Studies Journal of Organic Chemistry, 2012, 77, 9784-9794 |
4022752 | CIF | C11 H13 N O2 | P 1 21/c 1 | 12.7887; 5.8349; 12.9579 90; 98.292; 90 | 956.82 | Philip J. Parsons; Alexander J. Waters; Daryl S. Walter; Johnathan Board A New Route to Highly Functionalized Heterocyclic Rings Journal of Organic Chemistry, 2007, 72, 1395-1398 |
4026698 | CIF | C11 H13 N O2 | P 1 21 1 | 12.9125; 6.3682; 13.7532 90; 117.733; 90 | 1001 | Chengtang Du; Fulong Li; Xuefeng Zhang; Wenxiang Hu; Qizheng Yao; Ao Zhang Lewis Acid Catalyzed Cyclization of Glycals/2-Deoxy-d-ribose with Arylamines: Additional Findings on Product Structure and Reaction Diastereoselectivity Journal of Organic Chemistry, 2011, 76, 8833-8839 |
4026699 | CIF | C11 H13 N O2 | P 31 2 1 | 5.983; 5.983; 46.449 90; 90; 120 | 1439.94 | Chengtang Du; Fulong Li; Xuefeng Zhang; Wenxiang Hu; Qizheng Yao; Ao Zhang Lewis Acid Catalyzed Cyclization of Glycals/2-Deoxy-d-ribose with Arylamines: Additional Findings on Product Structure and Reaction Diastereoselectivity Journal of Organic Chemistry, 2011, 76, 8833-8839 |
4022697 | CIF | C11 H13 N O2 S | P 21 21 21 | 8.9647; 9.7275; 12.0253 90; 90; 90 | 1048.7 | Paul Evans The Double Reduction of Cyclic Sulfonamides for the Synthesis of (4S-Phenylpyrrolidin-2R-yl)methanol and 2S-Methyl-4S-phenylpyrrolidine Journal of Organic Chemistry, 2007, 72, 1830-1833 |
4034659 | CIF | C11 H13 N O2 S | P 1 21/n 1 | 11.2985; 6.4748; 15.103 90; 104.709; 90 | 1068.7 | Achar, Tapas Kumar; Biswas, Jyoti Prasad; Porey, Sandip; Pal, Tapas; Ramakrishna, Kankanala; Maiti, Siddhartha; Maiti, Debabrata Palladium-Catalyzed Template Directed C-5 Selective Olefination of Thiazoles. The Journal of organic chemistry, 2019, 84, 8315-8321 |
4020581 | CIF | C11 H13 N O3 | P n a 21 | 18.052; 5.7905; 10.1108 90; 90; 90 | 1056.9 | Alan R. Katritzky; Ashraf A. A. Abdel-Fattah; Anna V. Gromova; Rachel Witek; Peter J. Steel α-Nitro Ketone Synthesis Using N-Acylbenzotriazoles Journal of Organic Chemistry, 2005, 70, 9211-9214 |
4034310 | CIF | C11 H13 N O3 | P 1 21 1 | 7.35354; 5.87211; 11.1184 90; 95.496; 90 | 477.894 | Takashima, Katsuki; Hayakawa, Daichi; Gouda, Hiroaki; Toyooka, Naoki Formal Syntheses of (-)-Lepadiformines A, C, and (-)-Fasicularin. The Journal of organic chemistry, 2019, 84, 5222-5229 |
4035934 | CIF | C11 H13 N O3 | P b c a | 13.4466; 9.1948; 17.3481 90; 90; 90 | 2144.9 | Ondari, Mark E.; Klosin, Jerzy; Froese, Robert D. J.; Kruper, William R.; MacDonald, Jason; Arriola, Dan J.; Bell, Bruce M.; Briggs, John R.; Kruper, William J. Mechanistic and Synthetic Implications of the Diol-Ritter Reaction: Unexpected Yet Reversible Pathways in the Regioselective Synthesis of Vicinal-Aminoalcohols. The Journal of organic chemistry, 2019, 84, 4715-4722 |
4037928 | CIF | C11 H13 N O3 | P -1 | 5.518; 12.69; 15.56 73.19; 90; 90 | 1043 | Chaudhari, Moreshwar Bhagwan; Jayan, Krishna; Gnanaprakasam, Boopathy Sn-Catalyzed Criegee-Type Rearrangement of Peroxyoxindoles Enabled by Catalytic Dual Activation of Esters and Peroxides. The Journal of organic chemistry, 2020 |
4022049 | CIF | C11 H13 N O3 S | P 1 21/n 1 | 6.0038; 8.1286; 23.0641 90; 90.5392; 90 | 1125.5 | David M. Hodgson; Bogdan Štefane; Timothy J. Miles; Jason Witherington Organolithium-Induced Alkylative Ring Opening of Aziridines: Synthesis of Unsaturated Amino Alcohols and Ethers Journal of Organic Chemistry, 2006, 71, 8510-8515 |
4038468 | CIF | C11 H13 N O5 S2 | P 21 21 21 | 6.043; 7.662; 27.127 90; 90; 90 | 1256 | Furuya, Shohei; Kanemoto, Kazuya; Fukuzawa, Shin-Ichi Copper-Catalyzed Asymmetric 1,3-Dipolar Cycloaddition of Imino Esters to Unsaturated Sultones. The Journal of organic chemistry, 2020 |
4023880 | CIF | C11 H13 N S | P n a 21 | 18.069; 5.9249; 9.399 90; 90; 90 | 1006.3 | Tetsuharu Hori; Yuko Otani; Masatoshi Kawahata; Kentaro Yamaguchi; Tomohiko Ohwada Nonplanar Structures of Thioamides Derived from 7-Azabicyclo[2.2.1]heptane. Electronically Tunable Planarity of Thioamides Journal of Organic Chemistry, 2008, 73, 9102-9108 |
4032321 | CIF | C11 H13 N3 O | P 1 21 1 | 5.9648; 34.2029; 10.1737 90; 91.052; 90 | 2075.22 | Safin, Damir A.; Mitoraj, Mariusz P.; Babashkina, Maria G.; Kubisiak, Piotr; Robeyns, Koen; Filinchuk, Yaroslav Alternative Route Toward Nitrones: Experimental and Theoretical Findings. The Journal of organic chemistry, 2017, 82, 1666-1675 |
4021934 | CIF | C11 H13 N3 O S2 | P 1 21 1 | 11.3709; 15.214; 7.2459 90; 90.484; 90 | 1253.5 | Shinji Yamada; Tomoko Misono; Yuko Iwai; Ayako Masumizu; Yukiko Akiyama New Class of Pyridine Catalyst Having a Conformation Switch System: Asymmetric Acylation of Various sec-Alcohols Journal of Organic Chemistry, 2006, 71, 6872-6880 |
4022620 | CIF | C11 H13 N3 O2 S2 | P 1 2/c 1 | 10.2805; 8.8859; 15.8645 90; 91.645; 90 | 1448.65 | Ali Asadi; Brian O. Patrick; David M. Perrin Janus-AT Bases: Synthesis, Self-Assembly, and Solid State Structures Journal of Organic Chemistry, 2007, 72, 466-475 |
4028159 | CIF | C11 H13 N5 | C 1 2/c 1 | 7.5759; 6.6953; 19.3769 90; 96.532; 90 | 976.47 | Joanna V. Geden; Alpa K. Pancholi; Michael Shipman Palladium-Catalyzed Multicomponent Synthesis of 2-Aryl-2-imidazolines from Aryl Halides and Diamines Journal of Organic Chemistry, 2013, 78, 4158-4164 |
4025803 | CIF | C11 H13 N5 O | P 21 21 21 | 6.644; 7.6383; 21.5272 90; 90; 90 | 1092.48 | Hisao Saneyoshi; Jeffrey R. Deschamps; Victor E. Marquez Synthesis of Conformationally Locked l-Deoxythreosyl Phosphonate Nucleosides Built on a Bicyclo[3.1.0]hexane Template Journal of Organic Chemistry, 2010, 75, 7659-7669 |
4027107 | CIF | C11 H13 N5 O2 S | P 1 21/c 1 | 14.0124; 6.3282; 15.2728 90; 106.082; 90 | 1301.29 | Thore Wendler; Christian Schütt; Christian Näther; Rainer Herges Photoswitchable Azoheterocycles via Coupling of Lithiated Imidazoles with Benzenediazonium Salts Journal of Organic Chemistry, 2012, 77, 3284-3287 |
4033661 | CIF | C11 H13 O2 S | P 1 21/c 1 | 11.9821; 14.3947; 6.1287 90; 100.021; 90 | 1040.94 | Crumbie, Robyn L.; Chalmers, Gareth; Bhadbhade, Mohan; Griffith, Renate Exploration of the Differences Between Amine and Thiolate Addition to Acetylenedicarboxylates. The Journal of organic chemistry, 2019 |
4023891 | CIF | C11 H14 Ag F3 O4 S3 | P 1 21/a 1 | 19.452; 8.2944; 22 90; 115.78; 90 | 3196 | Ines Vujasinović; Jelena Veljković; Krešimir Molčanov; Biserka Kojić-Prodić; Kata Mlinarić-Majerski Thiamacrocyclic Lactones: New Ag(I)-Ionophores Journal of Organic Chemistry, 2008, 73, 9221-9227 |
4021200 | CIF | C11 H14 B3 N O3 | P 1 21/n 1 | 8.2029; 19.488; 8.3016 90; 90.423; 90 | 1327 | Neola F. McKinley; Donal F. O'Shea Efficient Synthesis of Aryl Vinyl Ethers Exploiting 2,4,6-Trivinylcyclotriboroxane as a Vinylboronic Acid Equivalent Journal of Organic Chemistry, 2004, 69, 5087-5092 |
4026494 | CIF | C11 H14 Br N O3 | P 1 21 1 | 10.0349; 5.879; 11.4499 90; 113.627; 90 | 618.87 | Lorenzo V. White; Brett D. Schwartz; Martin G. Banwell; Anthony C. Willis A Chemoenzymatic Total Synthesis of (+)-Clividine Journal of Organic Chemistry, 2011, 76, 6250-6257 |
4035292 | CIF | C11 H14 Cl N5 | P 1 21/c 1 | 12.4879; 9.0357; 11.6782 90; 106.091; 90 | 1266.11 | Pathare, Ramdas S.; Ansari, Arshad J.; Verma, Sarika; Maurya, Anand; Maurya, Antim K.; Agnihotri, Vijai K.; Sharon, Ashoke; Pardasani, Ram T.; Sawant, Devesh M. Sequential Pd(0)/Fe(III) Catalyzed Azide-Isocyanide Coupling/Cyclization Reaction: One-Pot Synthesis of Aminotetrazoles. The Journal of organic chemistry, 2018, 83, 9530-9537 |
4033649 | CIF | C11 H14 Cl N5 O3 Se | P 21 21 21 | 7.515; 7.7136; 24.1346 90; 90; 90 | 1399.03 | Lee, Hyejin; Jarhad, Dnyandev B.; Yu, Jinha; Lee, Choongho; Jeong, Lak Shin Asymmetric Synthesis of 2'-<i>C</i>-Methyl-4'-selenonucleosides as Anti-Hepatitis C Virus Agents. The Journal of organic chemistry, 2019 |
4035933 | CIF | C11 H14 Cl6 N O3 Sb | P 1 21/n 1 | 9.8238; 19.393; 9.8685 90; 94.8734; 90 | 1873.3 | Ondari, Mark E.; Klosin, Jerzy; Froese, Robert D. J.; Kruper, William R.; MacDonald, Jason; Arriola, Dan J.; Bell, Bruce M.; Briggs, John R.; Kruper, William J. Mechanistic and Synthetic Implications of the Diol-Ritter Reaction: Unexpected Yet Reversible Pathways in the Regioselective Synthesis of Vicinal-Aminoalcohols. The Journal of organic chemistry, 2019, 84, 4715-4722 |
4034826 | CIF | C11 H14 N2 O Se | P 1 21/c 1 | 14.3705; 8.1129; 10.191 90; 93.616; 90 | 1185.77 | Shangpliang, O. Risuklang; Kshiar, Baskhemlang; Wanniang, Kmendashisha; Marpna, Ibakyntiew D.; Lipon, Tyrchain Mitre; Laloo, Badaker M.; Myrboh, Bekington Selenium Dioxide As an Alternative Reagent for the Direct α-Selenoamidation of Aryl Methyl Ketones. The Journal of organic chemistry, 2018, 83, 5829-5835 |
4034830 | CIF | C11 H14 N2 O Se | P 1 21/c 1 | 13.1752; 7.1057; 13.7654 90; 111.1; 90 | 1202.3 | Shangpliang, O. Risuklang; Kshiar, Baskhemlang; Wanniang, Kmendashisha; Marpna, Ibakyntiew D.; Lipon, Tyrchain Mitre; Laloo, Badaker M.; Myrboh, Bekington Selenium Dioxide As an Alternative Reagent for the Direct α-Selenoamidation of Aryl Methyl Ketones. The Journal of organic chemistry, 2018, 83, 5829-5835 |
4034993 | CIF | C11 H14 N2 O2 | P b c a | 10.6419; 9.2073; 22.7567 90; 90; 90 | 2229.77 | Saha, Amrita; Bhattacharyya, Aditya; Talukdar, Ranadeep; Ghorai, Manas K. Stereospecific Syntheses of Enaminonitriles and β-Enaminoesters via Domino Ring-Opening Cyclization (DROC) of Activated Cyclopropanes with Pronucleophilic Malononitriles. The Journal of organic chemistry, 2018, 83, 2131-2144 |
4034996 | CIF | C11 H14 N2 O2 | P -1 | 7.676; 7.865; 9.394 104.851; 96.825; 94.814 | 540.4 | Saha, Amrita; Bhattacharyya, Aditya; Talukdar, Ranadeep; Ghorai, Manas K. Stereospecific Syntheses of Enaminonitriles and β-Enaminoesters via Domino Ring-Opening Cyclization (DROC) of Activated Cyclopropanes with Pronucleophilic Malononitriles. The Journal of organic chemistry, 2018, 83, 2131-2144 |
4036290 | CIF | C11 H14 N2 O2 | P 1 21 1 | 5.3134; 8.1507; 12.0605 90; 93.485; 90 | 521.35 | Conde, Egoitz; Rivilla, Iván; Larumbe, Amaia; Cossío, Fernando P Enantiodivergent Synthesis of Bis-Spiropyrrolidines via Sequential Interrupted and Completed (3 + 2) Cycloadditions. The Journal of organic chemistry, 2015, 80, 11755-11767 |
4029522 | CIF | C11 H14 N2 O3 S | P -1 | 7.90888; 8.8674; 9.2796 83.012; 69.9059; 75.1847 | 590.45 | Yoneda, Tetsuya; Tabata, Hidetsugu; Nakagomi, Jun; Tasaka, Tomohiko; Oshitari, Tetsuta; Takahashi, Hideyo; Natsugari, Hideaki N-Benzoyl- and N-Sulfonyl-1,5-benzodiazepines: Comparison of Their Atropisomeric and Conformational Properties. The Journal of organic chemistry, 2014, 79, 5717-5727 |
4028819 | CIF | C11 H14 N2 O4 | P -1 | 9.4112; 9.797; 13.2108 100.766; 94.837; 105.426 | 1141.9 | Sunkyu Han; Dustin S. Siegel; Karen C. Morrison; Paul J. Hergenrother; Mohammad Movassaghi Synthesis and Anticancer Activity of All Known (-)-Agelastatin Alkaloids Journal of Organic Chemistry, 2013, 78, 11970-11984 |
4029471 | CIF | C11 H14 N2 O4 S | P 1 21 1 | 7.3131; 12.6022; 28.2003 90; 95.198; 90 | 2588.28 | Kelley, Brandon T.; Carroll, Patrick; Joullié, Madeleine M Possible Reason for the Unusual Regioselectivity in Nucleophilic Ring Opening of Trisubstituted Aziridines under Mildly Basic Conditions. The Journal of organic chemistry, 2014, 79, 5121-5133 |
4024948 | CIF | C11 H14 N2 O5 | P 1 21 1 | 7.1811; 5.3996; 15.6994 90; 91.705; 90 | 608.48 | Gérald Enderlin; Claude Taillefumier; Claude Didierjean; Yves Chapleur An Efficient Route to Acyclic C-Nucleosides and Fused-Ring Analogues of Uridine fromexo-Glycals Journal of Organic Chemistry, 2009, 74, 8388-8391 |
4025269 | CIF | C11 H14 N2 O6 | P 21 21 21 | 6.3433; 12.8094; 14.2708 90; 90; 90 | 1159.6 | Punit P. Seth; Guillermo Vasquez; Charles A. Allerson; Andres Berdeja; Hans Gaus; Garth A. Kinberger; Thazha P. Prakash; Michael T. Migawa; Balkrishen Bhat; Eric E. Swayze Synthesis and Biophysical Evaluation of 2',4'-Constrained 2'O-Methoxyethyl and 2',4'-Constrained 2'O-Ethyl Nucleic Acid Analogues Journal of Organic Chemistry, 2010, 75, 1569-1581 |
4020389 | CIF | C11 H14 N3 O5 P | P -1 | 8.1636; 8.7184; 10.1021 79.409; 74.124; 81.613 | 676.31 | Diana S. Stoianova; Alan Whitehead; Paul R. Hanson P-Heterocyclic Building Blocks: Application to the Stereoselective Synthesis of P-Sugars. Journal of Organic Chemistry, 2005, 70, 5880-5889 |
4029567 | CIF | C11 H14 N4 O3 | P 1 21/a 1 | 8.4106; 9.3443; 16.3224 90; 95.741; 90 | 1276.36 | García-Egido, Eduardo; Fernandez-Suarez, Miryam; Muñoz, Luis Synthesis of carbamoyl azides from primary amines and carbon dioxide under mild conditions. The Journal of organic chemistry, 2008, 73, 2909-2911 |
4026875 | CIF | C11 H14 N4 O4 | P n m a | 12.4218; 11.3954; 8.1359 90; 90; 90 | 1151.65 | Feng Wu; Li-Hui Wu; Xin Xiao; Yun-Qian Zhang; Sai-Feng Xue; Zhu Tao; Anthony I. Day Locating the Cyclopentano Cousins of the Cucurbit[n]uril Family Journal of Organic Chemistry, 2012, 77, 606-611 |
4032105 | CIF | C11 H14 N6 O6 | P 21 21 21 | 6.53502; 12.7185; 16.1657 90; 90; 90 | 1343.62 | Mitsuoka, Yasunori; Yamamoto, Tsuyoshi; Kugimiya, Akira; Waki, Reiko; Wada, Fumito; Tahara, Saori; Sawamura, Motoki; Noda, Mio; Fujimura, Yuko; Kato, Yuki; Hari, Yoshiyuki; Obika, Satoshi Triazole- and Tetrazole-Bridged Nucleic Acids: Synthesis, Duplex Stability, Nuclease Resistance, and in Vitro and in Vivo Antisense Potency. The Journal of organic chemistry, 2017, 82, 12-24 |
4034010 | CIF | C11 H14 O | P c c n | 20.0831; 7.6632; 10.9517 90; 90; 90 | 1685.48 | Lee, Robert; Bashrum, Bryan; Cagle, Ethan C.; Walters, Jillian; Massey, Jake; Zanghi, Monica; Birchfield, Carolyn; French, David; Joy, Jessica; Dos Passos Gomes, Gabriel; Wiget, Paul A. Electronic Donation or Steric Contraction: A Spectroscopic and Structural Analysis of Medium-Sized Constrained Rings for Potential Long-Range Hyperconjugation. The Journal of organic chemistry, 2019, 84, 9897-9906 |
4022456 | CIF | C11 H14 O2 | C 1 2/c 1 | 22.1341; 7.6802; 11.0101 90; 107.876; 90 | 1781.3 | Richard S. Grainger; Richard B. Owoare; Patrizia Tisselli; Jonathan W. Steed A Synthetic Alternative to the Type-II Intramolecular 4 + 3 Cycloaddition Reaction Journal of Organic Chemistry, 2003, 68, 7899-7902 |
4034109 | CIF | C11 H14 O2 | P 1 21 1 | 7.3685; 4.8732; 13.2304 90; 95.679; 90 | 472.75 | Hokamp, Tobias; Wirth, Thomas Structurally Defined α-Tetralol-Based Chiral Hypervalent Iodine Reagents. The Journal of organic chemistry, 2019, 84, 8674-8682 |
4031865 | CIF | C11 H14 O2 S2 | P b c a | 11.059; 11.569; 17.329 90; 90; 90 | 2217.1 | Picado, Alfredo; Li, ShengJian; Dieter, R. Karl A Serendipitous Synthesis of Bis-Heterocyclic Spiro 3(2H)-Furanones. The Journal of organic chemistry, 2016, 81, 1391-1400 |
4036254 | CIF | C11 H14 O3 | P 1 | 5.8748; 6.6516; 7.3831 67.621; 84.526; 66.767 | 244.64 | Mostinski, Yelena; Valerio, Viviana; Lankri, David; Tsvelikhovsky, Dmitry Synthesis of Tricyclic Spiranoid Lactones via I2/Sm(II)- and I2/Pd(0)-Mediated Cyclizations of a Common Cycloalkylmethylene Precursor. The Journal of organic chemistry, 2015, 80, 10464-10473 |
4037765 | CIF | C11 H14 O3 S2 | P 1 21/c 1 | 10.128; 15.5124; 8.2549 90; 101.942; 90 | 1268.9 | He, Yuan; Lou, Jiang; Wu, Ping; Zhou, Yong-Gui; Yu, Zhengkun Copper-Catalyzed Annulative Coupling of <i>S</i>,<i>S</i>-Disubstituted Enones with Diazo Compounds to Access Highly Functionalized Thiophene Derivatives. The Journal of organic chemistry, 2019 |
4021841 | CIF | C11 H14 O4 | P 1 21/n 1 | 10.899; 5.554; 17.6497 90; 107.704; 90 | 1017.79 | Emma L. Pearson; Laurence C. H. Kwan; Craig I. Turner; Garth A. Jones; Anthony C. Willis; Michael N. Paddon-Row; Michael S. Sherburn Intramolecular Diels-Alder Reactions of Ester Linked 1,3,9-Decatrienes: Cis/Trans Selectivity in Thermal and Lewis Acid Promoted Reactions of Ethylene-Tethered and Benzo-Tethered Systems Journal of Organic Chemistry, 2006, 71, 6099-6109 |
4021842 | CIF | C11 H14 O4 | C 1 2/c 1 | 17.9961; 8.5436; 13.6219 90; 94.962; 90 | 2086.54 | Emma L. Pearson; Laurence C. H. Kwan; Craig I. Turner; Garth A. Jones; Anthony C. Willis; Michael N. Paddon-Row; Michael S. Sherburn Intramolecular Diels-Alder Reactions of Ester Linked 1,3,9-Decatrienes: Cis/Trans Selectivity in Thermal and Lewis Acid Promoted Reactions of Ethylene-Tethered and Benzo-Tethered Systems Journal of Organic Chemistry, 2006, 71, 6099-6109 |
4026602 | CIF | C11 H14 O4 | P 1 21 1 | 6.7734; 6.7395; 11.0228 90; 99.636; 90 | 496.08 | Jan Štambaský; Vojtěch Kapras; Martin Štefko; Ondřej Kysilka; Michal Hocek; Andrei V. Malkov; Pavel Kočovský A Modular Approach to Aryl-C-ribonucleosides via the Allylic Substitution and Ring-Closing Metathesis Sequence. A Stereocontrolled Synthesis of All Four α-/β- and d-/l-C-Nucleoside Stereoisomers Journal of Organic Chemistry, 2011, 76, 7781-7803 |
4026603 | CIF | C11 H14 O4 | P 1 21 1 | 6.763; 6.781; 11.095 90; 99.41; 90 | 502 | Jan Štambaský; Vojtěch Kapras; Martin Štefko; Ondřej Kysilka; Michal Hocek; Andrei V. Malkov; Pavel Kočovský A Modular Approach to Aryl-C-ribonucleosides via the Allylic Substitution and Ring-Closing Metathesis Sequence. A Stereocontrolled Synthesis of All Four α-/β- and d-/l-C-Nucleoside Stereoisomers Journal of Organic Chemistry, 2011, 76, 7781-7803 |
4023699 | CIF | C11 H14 O4 S | P 1 21/c 1 | 7.5897; 9.957; 15.34 90; 99.483; 90 | 1143.5 | Stéphane Perreault; Maude Poirier; Pascal Léviellé; Olivier René; Pascal Joly; Yves Dory; Claude Spino Mechanism and Regioselectivity of the Cycloaddition of Thiones Derived from Meldrum's Acid, Malonates, or Other Dicarbonyls Journal of Organic Chemistry, 2008, 73, 7457-7466 |
4020724 | CIF | C11 H14 O6 | P 21 21 21 | 5.384; 12.0829; 17.7316 90; 90; 90 | 1153.52 | N. Nieto; P. Molas; J. Benet-Buchholz; A. Vidal-Ferran Practical Synthesis of Shi's Diester Fructose Derivative for Catalytic Asymmetric Epoxidation of Alkenes Journal of Organic Chemistry, 2005, 70, 10143-10146 |
4023724 | CIF | C11 H15 Br O3 | P 1 21/c 1 | 8.8986; 12.667; 10.1926 90; 97.923; 90 | 1137.9 | Michael D. Markey; T. Ross Kelly Synthesis of Cribrostatin 6 Journal of Organic Chemistry, 2008, 73, 7441-7443 |
4031290 | CIF | C11 H15 Cl N4 O2 | P -1 | 5.1161; 9.4299; 13.2397 73.055; 81.356; 89.632 | 603.6 | Lee, Mijoon; Rucil, Tomas; Hesek, Dusan; Oliver, Allen G.; Fisher, Jed F.; Mobashery, Shahriar Regioselective Control of the SNAr Amination of 5-Substituted-2,4-Dichloropyrimidines Using Tertiary Amine Nucleophiles. The Journal of organic chemistry, 2015, 80, 7757-7763 |
4020465 | CIF | C11 H15 F2 N3 O | P 1 21/c 1 | 8.7228; 18.3386; 7.2367 90; 99.587; 90 | 1141.44 | Graham Sandford; Rachel Slater; Dmitrii S. Yufit; Judith A. K. Howard; Antonio Vong Tetrahydropyrido[3,4-b]pyrazine Scaffolds from Pentafluoropyridine Journal of Organic Chemistry, 2005, 70, 7208-7216 |
4033658 | CIF | C11 H15 F3 N2 O3 | P 1 21 1 | 5.2476; 18.201; 14.8426 90; 90.1; 90 | 1417.6 | Chalyk, Bohdan A.; Hrebeniuk, Kateryna V.; Fil, Yulia V.; Gavrilenko, Konstantin S.; Rozhenko, Alexander B.; Vashchenko, Bohdan V.; Borysov, Oleksandr V.; Biitseva, Angelina V.; Lebed, Pavlo S.; Bakanovych, Iulia; Moroz, Yurii S.; Grygorenko, Oleksandr O. Synthesis of 5-(Fluoroalkyl)isoxazole Building Blocks by Regioselective Reactions of Functionalized Halogenoximes. The Journal of organic chemistry, 2019 |
4037996 | CIF | C11 H15 I N2 O2 | P -1 | 9.2857; 9.7065; 16.1028 72.507; 76.823; 87.285 | 1347.45 | Dwadnia, Nejib; Lingua, Hugo; Mouysset, Dominique; Mimoun, Liliane; Siri, Didier; Bertrand, Michèle P; Feray, Laurence Intermolecular addition of carbon-centered radicals to ynamides - A regio- and stereoselective route to persubstituted α-iodo-enamides. The Journal of organic chemistry, 2020 |
4029467 | CIF | C11 H15 N O2 S | P 1 21/n 1 | 12.4009; 7.2781; 12.4672 90; 94.562; 90 | 1121.66 | Kelley, Brandon T.; Carroll, Patrick; Joullié, Madeleine M Possible Reason for the Unusual Regioselectivity in Nucleophilic Ring Opening of Trisubstituted Aziridines under Mildly Basic Conditions. The Journal of organic chemistry, 2014, 79, 5121-5133 |
4025587 | CIF | C11 H15 N O2 S2 | P 1 21/n 1 | 5.17; 29.506; 8.522 90; 100.04; 90 | 1280.1 | Devarajulu Sureshkumar; Srinivasamurthy Koutha; Venkataraman Ganesh; Srinivasan Chandrasekaran Tetrathiomolybdate Mediated Rearrangement of Aziridinemethanol Tosylates: A Thia-Aza-Payne Rearrangement Journal of Organic Chemistry, 2010, 75, 5533-5541 |
4025588 | CIF | C11 H15 N O2 S3 | P 1 21/n 1 | 12.47; 7.347; 15.965 90; 112.404; 90 | 1352.3 | Devarajulu Sureshkumar; Srinivasamurthy Koutha; Venkataraman Ganesh; Srinivasan Chandrasekaran Tetrathiomolybdate Mediated Rearrangement of Aziridinemethanol Tosylates: A Thia-Aza-Payne Rearrangement Journal of Organic Chemistry, 2010, 75, 5533-5541 |
4027572 | CIF | C11 H15 N O3 | P 1 21/c 1 | 8.0841; 6.8413; 20.348 90; 103.655; 90 | 1093.6 | K. V. Sajna; K. C. Kumara Swamy Vinyl Azides Derived from Allenes: Thermolysis Leading to Multisubstituted 1,4-Pyrazines and Mn(III)-Catalyzed Photochemical Reaction Leading to Pyrroles Journal of Organic Chemistry, 2012, 77, 8712-8722 |
4024620 | CIF | C11 H15 N O3 S | P 1 21/c 1 | 8.068; 18.294; 8.815 90; 111.694; 90 | 1208.8 | Ali Reza Modarresi-Alam; Homeyra Alsadat Amirazizi; Hajar Bagheri; Hamid-Reza Bijanzadeh; Erich Kleinpeter Dynamic 1H NMR Spectroscopic Study of the Ring Inversion in N-Sulfonyl Morpholines-Studies on N-S Interactions Journal of Organic Chemistry, 2009, 74, 4740-4746 |
4026514 | CIF | C11 H15 N O4 | P 1 21 1 | 5.03627; 10.7538; 10.169 90; 97.824; 90 | 545.62 | Martin Štefko; Lenka Slavětínská; Blanka Klepetářová; Michal Hocek General and Modular Synthesis of Isomeric 5-Substituted Pyridin-2-yl and 6-Substituted Pyridin-3-yl C-Ribonucleosides Bearing Diverse Alkyl, Aryl, Hetaryl, Amino, Carbamoyl, and Hydroxy Groups Journal of Organic Chemistry, 2011, 76, 6619-6635 |
4020538 | CIF | C11 H15 N O4 S | P 1 21 1 | 7.11; 10.412; 9.457 90; 110.29; 90 | 656.6 | Nigel A. Jones; Sergey A. Nepogodiev; Colin J. MacDonald; David L. Hughes; Robert A. Field Synthesis of the Branched-Chain Sugar Aceric Acid: A Unique Component of the Pectic Polysaccharide Rhamnogalacturonan-II Journal of Organic Chemistry, 2005, 70, 8556-8559 |
4023597 | CIF | C11 H15 N O4 S | P 21 21 21 | 6.8947; 10.767; 15.24 90; 90; 90 | 1131.4 | Yusuke Takezawa; Kentaro Tanaka; Maiko Yori; Shohei Tashiro; Motoo Shiro; Mitsuhiko Shionoya Soft Metal-Mediated Base Pairing with Novel Synthetic Nucleosides Possessing an O,S-Donor Ligand Journal of Organic Chemistry, 2008, 73, 6092-6098 |
4024461 | CIF | C11 H15 N O5 | P -1 | 6.2233; 7.3164; 13.5519 77.0301; 76.9064; 81.554 | 582.67 | Elise Claveau; Isabelle Gillaizeau; Justyna Kalinowska-Tluscik; Pascal Bouyssou; Gérard Coudert Nucleophilic Addition onto Methyl-4H-1,4-oxazine-3-carboxylate Moiety: Short Access to 1,4-Diazine Privileged Substructures Journal of Organic Chemistry, 2009, 74, 2911-2914 |
4033372 | CIF | C11 H15 N O6 | P 21 21 21 | 9.5218; 11.0694; 11.599 90; 90; 90 | 1222.54 | González, Marcos A; Estévez, Amalia M; Campos, María; Estévez, Juan C; Estévez, Ramón J Protocol for the Incorporation of γ-Amino Acids into Peptides: Application to (-)-Shikimic Acid Based 2-Amino-Methylcyclohexanecarboxylic Acids. The Journal of organic chemistry, 2018, 83, 1543-1550 |
4021356 | CIF | C11 H15 N2 O2 S2 | P b c n | 21.577; 7.3939; 15.952 90; 90; 90 | 2545 | Akiyuki Hamasaki; Richard Ducray; Dale L. Boger Two Novel 1,2,4,5-Tetrazines that Participate in Inverse Electron Demand Diels-Alder Reactions with an Unexpected Regioselectivity Journal of Organic Chemistry, 2006, 71, 185-193 |
4026684 | CIF | C11 H15 N3 O2 | P 1 21/c 1 | 7.9242; 15.6107; 10.0393 90; 105.906; 90 | 1194.34 | Philippe Le Grel; Arnaud Salaün; Clémence Mocquet; Barbara Le Grel; Thierry Roisnel; Michel Potel Z/E Isomerism in Nα-Nα-Disubstituted Hydrazides and the Amidoxy Bond: Application to the Conformational Analysis of Pseudopeptides Built of Hydrazinoacids and α-Aminoxyacids Journal of Organic Chemistry, 2011, 76, 8756-8767 |
4024451 | CIF | C11 H15 N4 O3 | P b c a | 10.644; 14.876; 15.388 90; 90; 90 | 2436.7 | Oleg N. Chupakhin; Irina A. Utepova; Mikhail V. Varaksin; Evgeny V. Tretyakov; Galina V. Romanenko; Dmitry V. Stass; Victor I. Ovcharenko SNH Approach in the Synthesis of Nitronyl Nitroxides Journal of Organic Chemistry, 2009, 74, 2870-2872 |
4025804 | CIF | C11 H15 N5 O2 | C 1 2 1 | 29.496; 8.2267; 10.584 90; 108.523; 90 | 2435.2 | Hisao Saneyoshi; Jeffrey R. Deschamps; Victor E. Marquez Synthesis of Conformationally Locked l-Deoxythreosyl Phosphonate Nucleosides Built on a Bicyclo[3.1.0]hexane Template Journal of Organic Chemistry, 2010, 75, 7659-7669 |
4022616 | CIF | C11 H15 N7 O2 | P 1 21/c 1 | 17.339; 19.36; 17.462 90; 117.007; 90 | 5222.5 | Ali Asadi; Brian O. Patrick; David M. Perrin Janus-AT Bases: Synthesis, Self-Assembly, and Solid State Structures Journal of Organic Chemistry, 2007, 72, 466-475 |
4024384 | CIF | C11 H16 Br Cl O2 | P 1 21/n 1 | 10.08901; 14.1397; 26.0378 90; 95.048; 90 | 3700.03 | D. Christopher Braddock; David S. Millan; Yolanda Pérez-Fuertes; Rebecca H. Pouwer; Richard N. Sheppard; Savade Solanki; Andrew J. P. White Bromonium Ion Induced Transannular Oxonium Ion Formation-Fragmentation in Model Obtusallene Systems and Structural Reassignment of Obtusallenes V-VII Journal of Organic Chemistry, 2009, 74, 1835-1841 |
4024386 | CIF | C11 H16 Br3 Cl O2 | P 21 21 21 | 9.43332; 10.8457; 14.12 90; 90; 90 | 1444.63 | D. Christopher Braddock; David S. Millan; Yolanda Pérez-Fuertes; Rebecca H. Pouwer; Richard N. Sheppard; Savade Solanki; Andrew J. P. White Bromonium Ion Induced Transannular Oxonium Ion Formation-Fragmentation in Model Obtusallene Systems and Structural Reassignment of Obtusallenes V-VII Journal of Organic Chemistry, 2009, 74, 1835-1841 |
4035342 | CIF | C11 H16 F2 O4 | P c a 21 | 18.0944; 6.5258; 18.8242 90; 90; 90 | 2222.8 | McCarter, Adam W.; Sommer, Magdalena; Percy, Jonathan M.; Jamieson, Craig; Kennedy, Alan R.; Hirst, David J. Atom Efficient Synthesis of Selectively Difluorinated Carbocycles through a Gold(I)-Catalyzed Cyclization. The Journal of organic chemistry, 2018, 83, 8888-8905 |
4037129 | CIF | C11 H16 F3 N O5 | P 1 21 1 | 8.9295; 14.3156; 21.898 90; 93.139; 90 | 2795 | Salih, Nabaz; Adams, Harry; Jackson, Richard F. W. Synthesis of ω-Oxo Amino Acids and trans-5-Substituted Proline Derivatives Using Cross-Metathesis of Unsaturated Amino Acids. The Journal of organic chemistry, 2016, 81, 8386-8393 |
4024194 | CIF | C11 H16 F6 N O6 P | P 1 21/n 1 | 7.083; 16.715; 14.637 90; 96.001; 90 | 1723.4 | Jinhua Song; Hiroshi Yamataka; Zvi Rappoport Dialkoxyphosphinyl-Substituted Enols of Carboxamides Journal of Organic Chemistry, 2007, 72, 7605-7624 |
4021344 | CIF | C11 H16 F6 O4 | P 1 21/c 1 | 6.7177; 23.6978; 8.5574 90; 96.05; 90 | 1354.71 | Scott M. Grayson; Brian K. Long; Shiro Kusomoto; Brian P. Osborn; Ryan P. Callahan; Charles R. Chambers; C. Grant Willson Synthesis and Characterization of Norbornanediol Isomers and Their Fluorinated Analogues Journal of Organic Chemistry, 2006, 71, 341-344 |
4021943 | CIF | C11 H16 N O5 P | P 1 21 1 | 6.0341; 6.6249; 16.5069 90; 98.184; 90 | 653.15 | María C. Fernández; Aniana Díaz; Juan J. Guillín; Olga Blanco; María Ruiz; Vicente Ojea Diastereoselective Synthesis of 2-Amino-4-phosphonobutanoic Acids by Electrophilic Substitution and Tin-Peterson Olefination of Bis-lactim Ethers Derived from cyclo-[L-AP4-D-Val] Journal of Organic Chemistry, 2006, 71, 6958-6974 |
4024197 | CIF | C11 H16 N O5 P | P c a 21 | 11.7792; 13.4173; 8.3445 90; 90; 90 | 1318.81 | Jinhua Song; Hiroshi Yamataka; Zvi Rappoport Dialkoxyphosphinyl-Substituted Enols of Carboxamides Journal of Organic Chemistry, 2007, 72, 7605-7624 |
4029529 | CIF | C11 H16 N2 O2 S | P -1 | 7.9146; 8.8541; 9.1732 104.507; 95.7341; 110.408 | 570.71 | Yoneda, Tetsuya; Tabata, Hidetsugu; Nakagomi, Jun; Tasaka, Tomohiko; Oshitari, Tetsuta; Takahashi, Hideyo; Natsugari, Hideaki N-Benzoyl- and N-Sulfonyl-1,5-benzodiazepines: Comparison of Their Atropisomeric and Conformational Properties. The Journal of organic chemistry, 2014, 79, 5717-5727 |
4037769 | CIF | C11 H16 N2 O4 | P -1 | 13.8348; 14.2875; 15.0081 75.879; 87.44; 65.866 | 2620.4 | Cheng, Bin; Li, Yuntong; Li, Hui; Zhang, Xinping; Wang, Taimin; Li, Yun; Zhai, Hongbin Switchable Ring-Contractive Extrusion Reactions of 2,5-Dihydro-1,4,5-thiadiazepine S-Oxides: Entries to Pyridazines or Pyrazoles. The Journal of organic chemistry, 2019 |
4035103 | CIF | C11 H16 N2 O7 | P 21 21 21 | 6.6418; 9.5458; 21.8207 90; 90; 90 | 1383.46 | Malek-Adamian, Elise; Patrascu, Mihai Burai; Jana, Sunit Kumar; Martínez-Montero, Saúl; Moitessier, Nicolas; Damha, Masad J. Adjusting the Structure of 2'-Modified Nucleosides and Oligonucleotides via C4'-α-F or C4'-α-OMe Substitution: Synthesis and Conformational Analysis. The Journal of organic chemistry, 2018, 83, 9839-9849 |
4020885 | CIF | C11 H16 O | P b c n | 21.31; 9.721; 8.755 89; 89; 90 | 1813.4 | Naoki Kise Theoretical Study of Electroreductive Intramolecular Coupling of Nonconjugated Olefinic and Aromatic Ketones Journal of Organic Chemistry, 2004, 69, 2147-2152 |
4020081 | CIF | C11 H16 O2 | P 1 21 1 | 6.435; 6.853; 12.112 90; 103.75; 90 | 518.8 | Agnese Abate; Elisabetta Brenna; Claudio Fuganti; Francesco G. Gatti; Tommaso Giovenzana; Luciana Malpezzi; Stefano Serra Journal of Organic Chemistry, 2005, 70, 1281-1290 |
4029681 | CIF | C11 H16 O2 | P 21 21 21 | 6.211; 9.483; 17.825 90; 90; 90 | 1049.9 | Abate, Agnese; Brenna, Elisabetta; Fuganti, Claudio; Gatti, Francesco G.; Giovenzana, Tommaso; Malpezzi, Luciana; Serra, Stefano Chirality and fragrance chemistry: stereoisomers of the commercial chiral odorants Muguesia and Pamplefleur. The Journal of organic chemistry, 2005, 70, 1281-1290 |
4029656 | CIF | C11 H16 O3 | P 1 21/c 1 | 6.282; 25.09; 6.268 90; 94.09; 90 | 985 | Liang, Demin; Zou, Yue; Wang, Quanrui; Goeke, Andreas Sequential Diels-Alder Reaction/Rearrangement Sequence: Synthesis of Functionalized Bicyclo[2.2.1]heptane Derivatives and Revision of Their Relative Configuration. The Journal of organic chemistry, 2014, 79, 6726-6731 |
4025686 | CIF | C11 H16 O3 S | F d d 2 | 12.0282; 34.3106; 11.2526 90; 90; 90 | 4643.89 | Michael G. Brant; Caleb M. Bromba; Jeremy E. Wulff Tandem Vinylogous 1,2-Addition/Anionic Oxy-Cope Reaction Leading from Butadiene Sulfone to an Orthogonally Functionalized Bicycle Journal of Organic Chemistry, 2010, 75, 6312-6315 |
4022630 | CIF | C11 H16 O4 | P 1 21/n 1 | 5.2387; 34.215; 6.2694 90; 109.54; 90 | 1059 | Md. Merajuddin Baag; Vedavati G. Puranik; Narshinha P. Argade Facile Chemo-, Regio-, and Diastereoselective Approach to cis-3,5-Disubstituted γ-Butyrolactones and Fused γ-Butyrolactones Journal of Organic Chemistry, 2007, 72, 1009-1012 |
4030415 | CIF | C11 H16 O4 S | P 21 21 21 | 6.4001; 8.8476; 19.4784 90; 90; 90 | 1102.97 | Olbrich, Martin; Mayer, Peter; Trauner, Dirk Synthetic Studies toward Polytwistane Hydrocarbon Nanorods. The Journal of organic chemistry, 2015, 80, 2042-2055 |
4025765 | CIF | C11 H16 O5 | P -1 | 7.9524; 8.2007; 9.4468 108.738; 107.45; 94.121 | 546.84 | Tyrone C. Casey; Julie Carlisle; Patrizia Tisselli; Louise Male; Neil Spencer; Richard S. Grainger Stereoselective α,α'-Annelation Reactions of 1,3-Dioxan-5-ones Journal of Organic Chemistry, 2010, 75, 7461-7464 |
4025767 | CIF | C11 H16 O5 | P 1 21/n 1 | 6.0448; 8.1728; 22.5871 90; 91.388; 90 | 1115.54 | Tyrone C. Casey; Julie Carlisle; Patrizia Tisselli; Louise Male; Neil Spencer; Richard S. Grainger Stereoselective α,α'-Annelation Reactions of 1,3-Dioxan-5-ones Journal of Organic Chemistry, 2010, 75, 7461-7464 |
4025769 | CIF | C11 H16 O6 | P 1 21/c 1 | 5.9826; 10.3401; 18.4246 90; 96.097; 90 | 1133.31 | Tyrone C. Casey; Julie Carlisle; Patrizia Tisselli; Louise Male; Neil Spencer; Richard S. Grainger Stereoselective α,α'-Annelation Reactions of 1,3-Dioxan-5-ones Journal of Organic Chemistry, 2010, 75, 7461-7464 |
4024537 | CIF | C11 H16 O7 | P 21 21 21 | 8.3781; 8.9255; 16.616 90; 90; 90 | 1242.5 | Bin Wang; Xin-Yan Wu; O. Andrea Wong; Brian Nettles; Mei-Xin Zhao; Dajun Chen; Yian Shi A Diacetate Ketone-Catalyzed Asymmetric Epoxidation of Olefins Journal of Organic Chemistry, 2009, 74, 3986-3989 |
4030612 | CIF | C11 H17 Br N2 O2 | P -1 | 5.909; 9.42; 12.251 97.002; 92.212; 103.538 | 656.4 | Huber, Tatjana; Kaiser, Daniel; Rickmeier, Jens; Magauer, Thomas Experimental Studies on the Selective β-C-H Halogenation of Enones. The Journal of organic chemistry, 2015, 80, 2281-2294 |
4030217 | CIF | C11 H17 Cl O2 | P -1 | 5.9783; 7.2121; 13.006 77.36; 79.561; 89.748 | 537.76 | Lin, Hsin-Hui; Lee, Kuan-Yi; Chen, Yin-An; Liu, Chi-Fan; Yeh, Ming-Chang P Diastereoselective synthesis of 2-arylmethylene-6-hydroxyspiro[4.5]deca-7-ones via FeCl3·6H2O-catalyzed spiroannulation/hydride transfer of 6-(5-arylpent-4-yn-1-yl)-7-oxabicyclo[4.1.0]heptan-2-ols. The Journal of organic chemistry, 2014, 79, 11802-11811 |
4025555 | CIF | C11 H17 F N2 O | P 21 21 21 | 6.08; 11.792; 15.073 90; 90; 90 | 1080.7 | Alexander D. Dilman; Pavel A. Belyakov; Marina I. Struchkova; Dmitry E. Arkhipov; Alexander A. Korlyukov; Vladimir A. Tartakovsky Fluorocyanation of Enamines Journal of Organic Chemistry, 2010, 75, 5367-5370 |
4032220 | CIF | C11 H17 I O4 | P 21 21 21 | 7.813; 11.5034; 14.4925 90; 90; 90 | 1302.53 | Taher, Ehab S.; Guest, Prue; Benton, Amanda; Ma, Xinghua; Banwell, Martin G.; Willis, Anthony C.; Seiser, Tobias; Newton, Trevor W.; Hutzler, Johannes The Synthesis of Certain Phomentrioloxin A Analogues and Their Evaluation as Herbicidal Agents. The Journal of organic chemistry, 2017, 82, 211-233 |
4027000 | CIF | C11 H17 I2 N O3 | P 21 21 21 | 7.9762; 13.5692; 14.1525 90; 90; 90 | 1531.73 | Adele E. Pasqua; James J. Crawford; De-Liang Long; Rodolfo Marquez Protecting Group Free, Stereocontrolled Synthesis of β-Halo-enamides Journal of Organic Chemistry, 2012, 77, 2149-2158 |
4035517 | CIF | C11 H17 N O2 | P 21 21 21 | 7.9924; 10.8848; 12.0467 90; 90; 90 | 1048.01 | Alujas-Burgos, Sílvia; Oliveras-González, Cristina; Álvarez-Larena, Ángel; Bayón, Pau; Figueredo, Marta Iterative Synthetic Strategy for Azaphenalene Alkaloids. Total Synthesis of (-)-9a epi-Hippocasine. The Journal of organic chemistry, 2018, 83, 5052-5057 |
4027001 | CIF | C11 H17 N O3 | P 1 | 5.8915; 6.4911; 8.4228 107.971; 101.168; 105.691 | 281.14 | Adele E. Pasqua; James J. Crawford; De-Liang Long; Rodolfo Marquez Protecting Group Free, Stereocontrolled Synthesis of β-Halo-enamides Journal of Organic Chemistry, 2012, 77, 2149-2158 |
4035031 | CIF | C11 H17 N O3 S | P 1 21 1 | 8.7848; 5.5237; 12.4287 90; 99.342; 90 | 595.1 | Przeslak, Adam D.; Inman, Martyn; Lewis, William; Moody, Christopher J. Origin of the Thiopyrone CTP-431 "Unexpectedly" Isolated from the Marine Sponge Cacospongia mycofijiensis. The Journal of organic chemistry, 2018, 83, 10595-10601 |
4022536 | CIF | C11 H17 N O4 | P 1 21/n 1 | 9.9807; 11.181; 11.4716 90; 110.209; 90 | 1201.4 | Grant R. Krow; Guoliang Lin; Seth B. Herzon; Andrew M. Thomas; Keith P. Moore; Qiuli Huang; Patrick J. Carroll Convenient Preparations of 2,4-Methanopyrrolidine and 5-Carboxy-2,4-methanopyrrolidines Journal of Organic Chemistry, 2003, 68, 7562-7564 |
4020875 | CIF | C11 H17 N O5 | P 21 21 21 | 5.986; 10.321; 19.807 90; 90; 90 | 1223.7 | François-Xavier Felpin; Kamal Boubekeur; Jacques Lebreton First Total Synthesis of 1-O-β-D-Glucopyranosyl-5-deoxyadenophorine and Its Aglycon Congener: Determination of the Absolute Configuration Journal of Organic Chemistry, 2004, 69, 1497-1503 |
4029170 | CIF | C11 H17 N O6 | P 1 21 1 | 6.5512; 10.8875; 9.1118 90; 105.048; 90 | 627.62 | Jiménez-Osés, Gonzalo; Aydillo, Carlos; Busto, Jesús H; Zurbano, María M; Peregrina, Jesús M; Avenoza, Alberto Influence of amino Acid stereocenters on the formation of bicyclic n,o-acetals. The Journal of organic chemistry, 2014, 79, 2556-2563 |
4029171 | CIF | C11 H17 N O6 | P 1 21 1 | 5.8457; 7.8597; 13.8602 90; 96.64; 90 | 632.54 | Jiménez-Osés, Gonzalo; Aydillo, Carlos; Busto, Jesús H; Zurbano, María M; Peregrina, Jesús M; Avenoza, Alberto Influence of amino Acid stereocenters on the formation of bicyclic n,o-acetals. The Journal of organic chemistry, 2014, 79, 2556-2563 |
4029172 | CIF | C11 H17 N O6 | P 1 21 1 | 5.761; 15.919; 6.736 90; 97.77; 90 | 612.08 | Jiménez-Osés, Gonzalo; Aydillo, Carlos; Busto, Jesús H; Zurbano, María M; Peregrina, Jesús M; Avenoza, Alberto Influence of amino Acid stereocenters on the formation of bicyclic n,o-acetals. The Journal of organic chemistry, 2014, 79, 2556-2563 |
4023266 | CIF | C11 H17 N3 O S | P 1 21/c 1 | 11.4101; 11.5764; 11.1033 90; 113.999; 90 | 1339.83 | Ahmad Basheer; Zvi Rappoport A Rich Array of Reactions of Cyanomonothiocarbonylmalonamides RNHCSCH(CN)CONHR' and Their Thioenols RNHC(SH)=C(CN)CONHR' Journal of Organic Chemistry, 2008, 73, 1386-1396 |
4026319 | CIF | C11 H17 N3 O4 | P 1 21 1 | 9.429; 10.488; 14.172 90; 108.53; 90 | 1328.83 | Lara Mata; Gonzalo Jiménez-Osés; Alberto Avenoza; Jesús H. Busto; Jesús M. Peregrina Stereocontrolled Ring-Opening of a Hindered Sulfamidate with Nitrogen-Containing Aromatic Heterocycles: Synthesis of Chiral Quaternary Imidazole Derivatives Journal of Organic Chemistry, 2011, 76, 4034-4042 |
4021544 | CIF | C11 H17 N5 O3 | P 1 21/c 1 | 9.9344; 13.5019; 10.2111 90; 102.034; 90 | 1339.5 | Grant R. Krow; Qiuli Huang; Guoliang Lin; Ryan A. Centafont; Andrew M. Thomas; Deepa Gandla; Charles DeBrosse; Patrick J. Carroll 5-Carboxy-2-azabicyclo[2.1.1]hexanes as Precursors of 5-Halo, Amino, Phenyl, and 2-Methoxycarbonylethyl Methanopyrrolidines Journal of Organic Chemistry, 2006, 71, 2090-2098 |
4029990 | CIF | C11 H17 N5 S2 | P -1 | 7.9239; 8.1833; 11.9333 86.14; 78.319; 65.964 | 691.97 | Koyioni, Maria; Manoli, Maria; Koutentis, Panayiotis A. Synthesis of fused 1,2,4-dithiazines and 1,2,3,5-trithiazepines. The Journal of organic chemistry, 2014, 79, 9717-9727 |
4023961 | CIF | C11 H17 N7 | C 1 2/c 1 | 26.452; 7.8096; 15.395 90; 125.151; 90 | 2600.3 | Weibing Lu; Sujata Sengupta; Jeffrey L. Petersen; Novruz G. Akhmedov; Xiaodong Shi Mitsunobu Coupling of Nucleobases and Alcohols: An Efficient, Practical Synthesis for Novel Nonsugar Carbon Nucleosides Journal of Organic Chemistry, 2007, 72, 5012-5015 |
4023104 | CIF | C11 H17 O2 | P 21 21 21 | 6.6268; 11.6519; 13.942 90; 90; 90 | 1076.53 | Ryan M. Moslin; Timothy F. Jamison Total Synthesis of (+)-Acutiphycin Journal of Organic Chemistry, 2007, 72, 9736-9745 |
4030580 | CIF | C11 H17 O2 P | P 21 21 21 | 6.195; 9.737; 19.016 90; 90; 90 | 1147.1 | Sowa, Sylwia; Stankevič, Marek; Szmigielska, Anna; Małuszyńska, Hanna; Kozioł, Anna E; Pietrusiewicz, K Michał Reduction of Functionalized Tertiary Phosphine Oxides with BH3. The Journal of organic chemistry, 2015, 80, 1672-1688 |
4035121 | CIF | C11 H18 B N | P 1 21/n 1 | 12.82; 6.017; 14.764 90; 104.3; 90 | 1103.6 | Andresini, Michael; De Angelis, Sonia; Uricchio, Antonella; Visaggio, Angelica; Romanazzi, Giuseppe; Ciriaco, Fulvio; Corriero, Nicola; Degennaro, Leonardo; Luisi, Renzo Azetidine-Borane Complexes: Synthesis, Reactivity, and Stereoselective Functionalization. The Journal of organic chemistry, 2018, 83, 10221-10230 |
4022259 | CIF | C11 H18 Cl3 N O3 | P b c a | 14.347; 17.944; 11.441 90; 90; 90 | 2945.4 | Timothy J. Donohoe; Kevin Blades; Peter R. Moore; Michael J. Waring; Jon J. G. Winter; Madeleine Helliwell; Nicholas J. Newcombe; Geoffrey Stemp Directed Dihydroxylation of Cyclic Allylic Alcohols and Trichloroacetamides Using OsO~4~/TMEDA Journal of Organic Chemistry, 2002, 67, 7946-7956 |
4035335 | CIF | C11 H18 F2 O2 | P 1 21/c 1 | 9.5614; 23.1922; 10.6309 90; 114.258; 90 | 2149.3 | McCarter, Adam W.; Sommer, Magdalena; Percy, Jonathan M.; Jamieson, Craig; Kennedy, Alan R.; Hirst, David J. Atom Efficient Synthesis of Selectively Difluorinated Carbocycles through a Gold(I)-Catalyzed Cyclization. The Journal of organic chemistry, 2018, 83, 8888-8905 |
4029024 | CIF | C11 H18 Li N O2 | P -1 | 8.1783; 8.8499; 9.4271 79.55; 68.433; 75.674 | 611.7 | Su, Chicheung; Guang, Jie; Williard, Paul G. Structures of Lithium N-Monosubstituted Anilides: Trisolvated Monomer to Tetrasolvated Dimer. The Journal of organic chemistry, 2014, 79, 1032 |
4027176 | CIF | C11 H18 N O2 S | P 21 21 21 | 7.4418; 9.7027; 16.862 90; 90; 90 | 1217.5 | Xiaofei Sun; Xingzhao Tu; Chuan Dai; Xiaoping Zhang; Binbin Zhang; Qingle Zeng Palladium-Catalyzed C-N Cross Coupling of Sulfinamides and Aryl Halides Journal of Organic Chemistry, 2012, 77, 4454-4459 |
4035448 | CIF | C11 H18 N4 O4 | P 1 21 1 | 9.9065; 6.007; 11.3732 90; 95.001; 90 | 674.22 | Zwick, 3rd, Christian R; Renata, Hans Evolution of Biocatalytic and Chemocatalytic C-H Functionalization Strategy in the Synthesis of Manzacidin C. The Journal of organic chemistry, 2018, 83, 7407-7415 |
4026870 | CIF | C11 H18 O2 | P b c a | 8.9673; 18.5999; 24.5171 90; 90; 90 | 4089.23 | Hung-Yi Lee; Chin-Kang Sha Stereoselective Total Synthesis of (\±)-Peribysin E Journal of Organic Chemistry, 2012, 77, 598-605 |
4021604 | CIF | C11 H18 O2 S2 | P b c a | 7.6871; 16.3111; 18.5766 90; 90; 90 | 2329.23 | Helen F. Sneddon; Alexandra van den Heuvel; Anna K. H. Hirsch; Richard A. Booth; David M. Shaw; Matthew J. Gaunt; Steven V. Ley Double Conjugate Addition of Dithiols to Propargylic Carbonyl Systems To Generate Protected 1,3-Dicarbonyl Compounds Journal of Organic Chemistry, 2006, 71, 2715-2725 |
4020504 | CIF | C11 H18 O3 S | C 1 2/c 1 | 24.277; 10.13; 9.365 90; 105.93; 90 | 2214.7 | María E. González Núñez; Jorge Royo; Rossella Mello; Minerva Báguena; Jaime Martínez Ferrer; Carmen Ramírez de Arellano; Gregorio Asensio; G. K. Surya Prakash Oxygenation of Alkane C-H Bonds with Methyl(trifluoromethyl)dioxirane: Effect of the Substituents and the Solvent on the Reaction Rate Journal of Organic Chemistry, 2005, 70, 7919-7924 |
4020505 | CIF | C11 H18 O3 S | C 1 2/c 1 | 24.44; 9.935; 9.545 90; 107.67; 90 | 2208.3 | María E. González Núñez; Jorge Royo; Rossella Mello; Minerva Báguena; Jaime Martínez Ferrer; Carmen Ramírez de Arellano; Gregorio Asensio; G. K. Surya Prakash Oxygenation of Alkane C-H Bonds with Methyl(trifluoromethyl)dioxirane: Effect of the Substituents and the Solvent on the Reaction Rate Journal of Organic Chemistry, 2005, 70, 7919-7924 |
4022543 | CIF | C11 H18 O3 S2 | P 1 21 1 | 6.5719; 9.6793; 10.2878 90; 99.94; 90 | 644.6 | Jason L. McCartney; Christopher T. Meta; Robert M. Cicchillo; Matthew D. Bernardina; Timothy R. Wagner; Peter Norris Addition of Lithiated C-Nucleophiles to 2,3-O-Isopropylidene-D-erythronolactone: Stereoselective Formation of a Furanose C-Disaccharide Journal of Organic Chemistry, 2003, 68, 10152-10155 |
4020501 | CIF | C11 H18 O4 S | C 1 2/c 1 | 32.987; 6.8136; 22.424 90; 111.084; 90 | 4702.6 | María E. González Núñez; Jorge Royo; Rossella Mello; Minerva Báguena; Jaime Martínez Ferrer; Carmen Ramírez de Arellano; Gregorio Asensio; G. K. Surya Prakash Oxygenation of Alkane C-H Bonds with Methyl(trifluoromethyl)dioxirane: Effect of the Substituents and the Solvent on the Reaction Rate Journal of Organic Chemistry, 2005, 70, 7919-7924 |
4020502 | CIF | C11 H18 O4 S | P -1 | 12.1189; 14.4813; 15.04 80.519; 78.775; 67.896 | 2386.5 | María E. González Núñez; Jorge Royo; Rossella Mello; Minerva Báguena; Jaime Martínez Ferrer; Carmen Ramírez de Arellano; Gregorio Asensio; G. K. Surya Prakash Oxygenation of Alkane C-H Bonds with Methyl(trifluoromethyl)dioxirane: Effect of the Substituents and the Solvent on the Reaction Rate Journal of Organic Chemistry, 2005, 70, 7919-7924 |
4027154 | CIF | C11 H18 O5 | P 1 21/c 1 | 10.686; 7.0118; 16.046 90; 107.784; 90 | 1144.8 | Nicole M. Cain; Edward R. T. Tiekink; Dennis K. Taylor Ozonolysis of Bicyclic 1,2-Dioxines: Initial Scope and Mechanistic Insights Journal of Organic Chemistry, 2012, 77, 3808-3819 |
4023434 | CIF | C11 H18 O7 S | P 21 21 21 | 5.5368; 14.889; 15.8296 90; 90; 90 | 1304.9 | Joy Krishna Maity; Ramprasad Ghosh; Michael G. B. Drew; Basudeb Achari; Sukhendu B. Mandal Introduction of Vinyl and Hydroxymethyl Functionalities at C-4 of Glucose-Derived Substrates: Synthesis of Spirocyclic, Bicyclic, and Tricyclic Nucleosides Journal of Organic Chemistry, 2008, 73, 4305-4308 |
4027962 | CIF | C11 H19 N O | P 21 21 21 | 5.8855; 8.2344; 21.4492 90; 90; 90 | 1039.5 | David M. Hodgson; Andrew Charlton; Robert S. Paton; Amber L. Thompson C-Alkylation of Chiral Tropane- and Homotropane-Derived Enamines Journal of Organic Chemistry, 2013, 78, 1508-1518 |
4027964 | CIF | C11 H19 N O | P 21 21 21 | 5.9046; 8.2614; 21.5105 90; 90; 90 | 1049.29 | David M. Hodgson; Andrew Charlton; Robert S. Paton; Amber L. Thompson C-Alkylation of Chiral Tropane- and Homotropane-Derived Enamines Journal of Organic Chemistry, 2013, 78, 1508-1518 |
4028847 | CIF | C11 H19 N O5 | I 4 | 16.9621; 16.9621; 9.6648 90; 90; 90 | 2780.69 | Kristína Csatayová; Stephen G. Davies; J. Gair Ford; James A. Lee; Paul M. Roberts; James E. Thomson Asymmetric Syntheses of Methyl N,O-Diacetyl-d-3-epi-daunosaminide and Methyl N,O-Diacetyl-d-ristosaminide Journal of Organic Chemistry, 2013, 78, 12397-12408 |
4027860 | CIF | C11 H19 N3 O3 | P 1 | 5.7004; 7.3619; 8.3143 108.938; 90.932; 104.803 | 317.19 | Jesus M. Aizpurua; Claudio Palomo; Eva Balentová; Azucena Jimenez; Elena Andreieff; Maialen Sagartzazu-Aizpurua; José Ignacio Miranda; Anthony Linden Chirality-Driven Folding of Short β-Lactam Pseudopeptides Journal of Organic Chemistry, 2013, 78, 224-237 |
4029293 | CIF | C11 H19 O2 | C 1 c 1 | 12.655; 10.193; 8.544 90; 102.529; 90 | 1075.9 | Zhu, Jia-Liang; Wu, Sih-Ting; Shie, Jr-Yun Access to Functionalized Bicyclo[4,3,0]nonenes via Palladium-Catalyzed Oxidative Cyclization of 2-Allylcyclohexyl Oximes. The Journal of organic chemistry, 2014, 79, 3623-3633 |
4028654 | CIF | C11 H20 Br N | P 21 21 21 | 6.5683; 13.156; 13.674 90; 90; 90 | 1181.6 | Zachary D. Aron; Tatsuya Ito; Tricia L. May; Larry E. Overman; Jocelyn Wang Enantioselective Synthesis of Angularly Substituted 1-Azabicylic Rings: Coupled Dynamic Kinetic Epimerization and Chirality Transfer Journal of Organic Chemistry, 2013, 78, 9929-9948 |
4025058 | CIF | C11 H20 Cl2 N2 O4 | P 1 21/c 1 | 8.681; 16.982; 11.343 90; 90.511; 90 | 1672 | Robin A. Weatherhead; Michael D. Carducci; Eugene A. Mash Synthesis of Conformationally Constrained Diaminodicarboxylic Acid Derivatives Journal of Organic Chemistry, 2009, 74, 8773-8778 |
4028459 | CIF | C11 H20 F3 N3 O5 S | P 1 21/n 1 | 8.9478; 14.984; 12.673 90; 91.953; 90 | 1698.1 | Christian Schnaars; Martin Hennum; Tore Bonge-Hansen Nucleophilic Halogenations of Diazo Compounds, a Complementary Principle for the Synthesis of Halodiazo Compounds: Experimental and Theoretical Studies Journal of Organic Chemistry, 2013, 78, 7488-7497 |
4026538 | CIF | C11 H20 N2 O4 S | P 1 21/c 1 | 20.08; 5.978; 12.389 90; 104.4; 90 | 1440.43 | Vladimir S. Yarmolchuk; Ivan L. Mukan; Oleksandr O. Grygorenko; Andrey A. Tolmachev; Svitlana V. Shishkina; Oleg V. Shishkin; Igor V. Komarov An Entry into Hexahydro-2H-thieno[2,3-c]pyrrole 1,1-Dioxide Derivatives Journal of Organic Chemistry, 2011, 76, 7010-7016 |
4020909 | CIF | C11 H20 N4 O2 | P 43 21 2 | 12.159; 12.159; 19.086 90; 90; 90 | 2821 | T. Govindaraju; Vaijayanti A. Kumar; Krishna N. Ganesh Synthesis and Evaluation of (1S,2R/1R,2S)-Aminocyclohexylglycyl PNAs as Conformationally Preorganized PNA Analogues for DNA/RNA Recognition Journal of Organic Chemistry, 2004, 69, 1858-1865 |
4022743 | CIF | C11 H20 O | I -4 | 15.694; 15.694; 8.2592 90; 90; 90 | 2034.2 | Gary A. Molander; Barbara Czakó; Michael Rheam Construction of Bicyclic Ring Systems via a Transannular SmI~2~-Mediated Ketone-Olefin Cyclization Strategy Journal of Organic Chemistry, 2007, 72, 1755-1764 |
4027027 | CIF | C11 H20 O4 | P 21 21 21 | 10.864; 13.608; 15.939 90; 90; 90 | 2356.4 | Ulf Scheffler; Rainer Mahrwald Histidine-Catalyzed Asymmetric Aldol Addition of Enolizable Aldehydes: Insights into its Mechanism Journal of Organic Chemistry, 2012, 77, 2310-2330 |
4032756 | CIF | C11 H21 N O | P 1 21/c 1 | 14.7624; 7.2144; 20.8003 90; 109.48; 90 | 2088.5 | Saruengkhanphasit, Rungroj; Collier, Darren; Coldham, Iain Synthesis of Spirocyclic Amines by Using Dipolar Cycloadditions of Nitrones. The Journal of organic chemistry, 2017, 82, 6489-6496 |
4025258 | CIF | C11 H21 N O4 | P 1 21 1 | 5.7989; 12.0265; 9.054 90; 107.068; 90 | 603.62 | Wen-Hua Chiou; Gau-Hong Lin; Chih-Wei Liang Facile Syntheses of Enantiopure 3-Hydroxypiperidine Derivatives and 3-Hydroxypipecolic Acids Journal of Organic Chemistry, 2010, 75, 1748-1751 |
4022569 | CIF | C11 H22 Cl N | P 1 21/n 1 | 10.515; 7.061; 16.081 90; 97.273; 90 | 1184.4 | Gary A. Molander; Shawn K. Pack Determining the Scope of the Organolanthanide-Catalyzed, Sequential Intramolecular Amination/Cyclization Reaction: Formation of Substituted Quinolizidines, Indolizidines, and Pyrrolizidines Journal of Organic Chemistry, 2003, 68, 9214-9220 |
4022568 | CIF | C11 H22 I N | P 1 21/c 1 | 6.529; 15.272; 13.117 90; 102.144; 90 | 1278.7 | Gary A. Molander; Shawn K. Pack Determining the Scope of the Organolanthanide-Catalyzed, Sequential Intramolecular Amination/Cyclization Reaction: Formation of Substituted Quinolizidines, Indolizidines, and Pyrrolizidines Journal of Organic Chemistry, 2003, 68, 9214-9220 |
4025124 | CIF | C11 H22 N2 O2 | C 1 2/c 1 | 24.5675; 9.4469; 12.9022 90; 99.489; 90 | 2953.5 | Nirupam Purkayastha; Deepak M. Shendage; Roland Fröhlich; Günter Haufe The Vinylfluoro Group as an Acetonyl Cation Equivalent: Stereoselective Synthesis of 6-Substituted 4-Hydroxy Pipecolic Acid Derivatives Journal of Organic Chemistry, 2010, 75, 222-225 |
4020743 | CIF | C11 H22 N4 O3 | P 1 21/c 1 | 11.6506; 15.143; 8.9226 90; 108.742; 90 | 1490.7 | Panchami Prabhakaran; Vedavati G. Puranik; Gangadhar J. Sanjayan Preorganizing Linear (Self-Complementary) Quadruple Hydrogen-Bonding Arrays Using Intramolecular Hydrogen Bonding as the Sole Force Journal of Organic Chemistry, 2005, 70, 10067-10072 |
4024350 | CIF | C11 H22 O4 | P 1 21/n 1 | 13.875; 6.1786; 15.772 90; 101.37; 90 | 1325.6 | Dnyaneshwar Gawas; Uli Kazmaier Highly Diastereoselectiveanti-Aldol Reactions of Glycolate Titanium Enolates Journal of Organic Chemistry, 2009, 74, 1788-1790 |
4022024 | CIF | C11 H22 O5 S2 | P 21 21 21 | 5.4985; 13.2676; 20.6881 90; 90; 90 | 1509.2 | Mattie S. M. Timmer; Bridget L. Stocker; Peter H. Seeberger De Novo Synthesis of Aceric Acid and an Aceric Acid Building Block Journal of Organic Chemistry, 2006, 71, 8294-8297 |
4025724 | CIF | C11 H23 B N2 | C 1 2/c 1 | 10.01; 11.528; 11.304 90; 102.9; 90 | 1271.5 | Malika Makhlouf Brahmi; Julien Monot; Marine Desage-El Murr; Dennis P. Curran; Louis Fensterbank; Emmanuel Lacôte; Max Malacria Preparation of NHC Borane Complexes by Lewis Base Exchange with Amine- and Phosphine-Boranes Journal of Organic Chemistry, 2010, 75, 6983-6985 |
4022136 | CIF | C11 H24 N2 O3 | P 21 a b | 7.9954; 10.9216; 14.4612 90; 90; 90 | 1262.79 | Albrecht Berkessel; Katrin Roland; Michael Schröder; Jörg M. Neudörfl; Johann Lex Enantiomerically Pure Isophorone Diamine [3-(Aminomethyl)-3,5,5-trimethylcyclohexylamine]: A Chiral 1,4-Diamine Building Block Made Available on Large Scale Journal of Organic Chemistry, 2006, 71, 9312-9318 |
4022844 | CIF | C11 H24 N3 O2 Pd0.5 | P 1 21/n 1 | 8.4892; 8.8035; 20.054 90; 93; 90 | 1496.6 | Shenghai Li; Yingjie Lin; Jungang Cao; Suobo Zhang Guanidine/Pd(OAc)~2~-Catalyzed Room Temperature Suzuki Cross-Coupling Reaction in Aqueous Media under Aerobic Conditions Journal of Organic Chemistry, 2007, 72, 4067-4072 |
4032734 | CIF | C11 H31 B N O P | P 1 21 1 | 8.0848; 13.4851; 14.869 90; 103.63; 90 | 1575.43 | Salomó, Ernest; Prades, Amparo; Riera, Antoni; Verdaguer, Xavier Dialkylammonium tert-Butylmethylphosphinites: Stable Intermediates for the Synthesis of P-Stereogenic Ligands. The Journal of organic chemistry, 2017, 82, 7065-7069 |
4023182 | CIF | C11 H5 F6 I O6 | P -1 | 14.302; 15.142; 17.101 97.53; 101.25; 90.66 | 3598.3 | Mekhman S. Yusubov; Tatyana V. Funk; Ki-Whan Chi; Eun-Hye Cha; Ghyung Hwa Kim; Andreas Kirschning; Viktor V. Zhdankin Preparation and X-ray Structures of 3-[Bis(trifluoroacetoxy)iodo]benzoic Acid and 3-[Hydroxy(tosyloxy)iodo]benzoic Acid: New Recyclable Hypervalent Iodine Reagents Journal of Organic Chemistry, 2008, 73, 295-297 |
4025417 | CIF | C11 H6 Br Cl2 N O2 | P 1 21/c 1 | 12.955; 12.25; 7.2861 90; 101.256; 90 | 1134.1 | Chambers C. Hughes; Christopher A. Kauffman; Paul R. Jensen; William Fenical Structures, Reactivities, and Antibiotic Properties of the Marinopyrroles A-F Journal of Organic Chemistry, 2010, 75, 3240-3250 |
4035386 | CIF | C11 H6 Br F3 N2 O2 | P 1 21/c 1 | 4.905; 18.25; 13.37 90; 90.86; 90 | 1197 | Wu, Jun; Zhang, Hui; Ding, Xiao; Tan, Xuefei; Chen, Jie; He, Weimin; Deng, Hongmei; Song, Liping; Shen, Hong C.; Cao, Weiguo Potassium Iodide-Promoted One-Pot Synthesis of Fluoroalkylated Quinoxalines via a Tandem Michael Addition/Azidation/Cycloamination Approach. The Journal of organic chemistry, 2018, 83, 9422-9429 |
4025267 | CIF | C11 H6 Br N S3 | P 21 21 21 | 3.9292; 9.9711; 30.306 90; 90; 90 | 1187.34 | Jean-Yves Balandier; Marcos Chas; Paul I. Dron; Sébastien Goeb; David Canevet; Ahmed Belyasmine; Magali Allain; Marc Sallé N-Aryl Pyrrolo-tetrathiafulvalene Based Ligands: Synthesis and Metal Coordination Journal of Organic Chemistry, 2010, 75, 1589-1599 |
4032212 | CIF | C11 H6 Cl N O S2 | P c a 21 | 14.1851; 9.0849; 8.6746 90; 90; 90 | 1117.9 | Arisawa, Mieko; Tazawa, Takeru; Tanii, Saori; Horiuchi, Kiyofumi; Yamaguchi, Masahiko Rhodium-Catalyzed Synthesis of Unsymmetric Di(heteroaryl) Sulfides Using Heteroaryl Ethers and S-Heteroaryl Thioesters via Heteroarylthio Exchange. The Journal of organic chemistry, 2017, 82, 804-810 |
4023233 | CIF | C11 H6 Cl2 I N3 O | P 1 21/n 1 | 7.1177; 24.8135; 21.9306 90; 98.1033; 90 | 3834.6 | Rachel L. Beingessner; Bo-Liang Deng; Phillip E. Fanwick; Hicham Fenniri A Regioselective Approach to Trisubstituted 2 (or 6)-Arylaminopyrimidine-5-carbaldehydes and Their Application in the Synthesis of Structurally and Electronically Unique G-C Base Precursors Journal of Organic Chemistry, 2008, 73, 931-939 |
4021691 | CIF | C11 H6 F2 O2 | P c a 21 | 20.703; 5.5301; 7.6557 90; 90; 90 | 876.5 | Yi Wang; Donald J. Burton A Facile, General Synthesis of 3,4-Difluoro-6-substituted-2-pyrones Journal of Organic Chemistry, 2006, 71, 3859-3862 |
4024039 | CIF | C11 H6 F5 N3 O2 | P n a 21 | 13.8073; 25.597; 14.0108 90; 90; 90 | 4951.8 | Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport Enols of Substituted Cyanomalonamides Journal of Organic Chemistry, 2007, 72, 5297-5312 |
4031329 | CIF | C11 H7 Br F6 O2 | P -1 | 7.1474; 9.7769; 10.0809 67.2457; 86.5387; 78.9053 | 637.4 | Ams, Mark R.; Fields, Michael; Grabnic, Timothy; Janesko, Benjamin G.; Zeller, Matthias; Sheridan, Rose; Shay, Amanda Unraveling the Role of Alkyl F on CH-π Interactions and Uncovering the Tipping Point for Fluorophobicity. The Journal of organic chemistry, 2015, 80, 7764-7769 |
4029106 | CIF | C11 H7 Br2 Cl N2 | P 21 21 21 | 3.8649; 11.0897; 26.1706 90; 90; 90 | 1121.69 | Vamos, Mitchell; Cosford, Nicholas D. P. 2-Aminopyridines via Reaction of Pyridine N-Oxides and Activated Isocyanides. The Journal of organic chemistry, 2014, 79, 2274-2280 |
4032998 | CIF | C11 H7 Cl3 N2 O | P 1 21/n 1 | 7.42034; 21.1494; 7.77399 90; 90.237; 90 | 1220.01 | Takahashi, Yuka; Ikeda, Hirotaka; Kanase, Yuki; Makino, Kosho; Tabata, Hidetsugu; Oshitari, Tetsuta; Inagaki, Satoshi; Otani, Yuko; Natsugari, Hideaki; Takahashi, Hideyo; Ohwada, Tomohiko Elucidation of the E-Amide Preference of N-Acyl Azoles. The Journal of organic chemistry, 2017, 82, 11370-11382 |
4024216 | CIF | C11 H7 I N4 | P 21 21 21 | 4.0595; 6.8131; 39.3862 90; 90; 90 | 1089.33 | Ghenia Bentabed-Ababsa; Fernando Blanco; Aïcha Derdour; Florence Mongin; François Trécourt; Guy Quéguiner; Rafael Ballesteros; Belén Abarca Deprotonative Magnesation and Cadmation of [1,2,3]Triazolo[1,5-a]pyridines Journal of Organic Chemistry, 2009, 74, 163-169 |
4032211 | CIF | C11 H7 N3 S | P 1 21/c 1 | 9.7434; 3.9162; 26.2218 90; 95.4561; 90 | 996.01 | Arisawa, Mieko; Tazawa, Takeru; Tanii, Saori; Horiuchi, Kiyofumi; Yamaguchi, Masahiko Rhodium-Catalyzed Synthesis of Unsymmetric Di(heteroaryl) Sulfides Using Heteroaryl Ethers and S-Heteroaryl Thioesters via Heteroarylthio Exchange. The Journal of organic chemistry, 2017, 82, 804-810 |
4032943 | CIF | C11 H8 B Cl F2 N2 O2 | P 1 2/c 1 | 13.986; 4.9867; 18.623 90; 111.799; 90 | 1206 | Sasano, Yoshifumi; Sato, Ryuma; Shigeta, Yasuteru; Yasuda, Nobuhiro; Maeda, Hiromitsu H-Aggregated π-Systems Based on Disulfide-Linked Dimers of Dipyrrolyldiketone Boron Complexes. The Journal of organic chemistry, 2017, 82, 11166-11172 |
4033934 | CIF | C11 H8 Br Cl O2 | P 1 21/c 1 | 10.7391; 7.356; 13.5262 90; 90.473; 90 | 1068.49 | Gholap, Sachin P.; Jangid, Dashrath; Fernandes, Rodney A. Metal-Free Brønsted Acid-Catalyzed Rearrangement of δ-Hydroxyalkynones to 2,3-Dihydro-4 H-pyran-4-ones: Total Synthesis of Obolactone and a Catechol Pyran Isolated from Plectranthus sylvestris. The Journal of organic chemistry, 2019, 84, 3537-3551 |
4033932 | CIF | C11 H8 Br I O2 | P 1 21/c 1 | 10.7766; 7.8221; 13.4995 90; 94.552; 90 | 1134.36 | Gholap, Sachin P.; Jangid, Dashrath; Fernandes, Rodney A. Metal-Free Brønsted Acid-Catalyzed Rearrangement of δ-Hydroxyalkynones to 2,3-Dihydro-4 H-pyran-4-ones: Total Synthesis of Obolactone and a Catechol Pyran Isolated from Plectranthus sylvestris. The Journal of organic chemistry, 2019, 84, 3537-3551 |
4033933 | CIF | C11 H8 Br2 O2 | P 1 21/c 1 | 10.6794; 7.5795; 13.4516 90; 92.023; 90 | 1088.15 | Gholap, Sachin P.; Jangid, Dashrath; Fernandes, Rodney A. Metal-Free Brønsted Acid-Catalyzed Rearrangement of δ-Hydroxyalkynones to 2,3-Dihydro-4 H-pyran-4-ones: Total Synthesis of Obolactone and a Catechol Pyran Isolated from Plectranthus sylvestris. The Journal of organic chemistry, 2019, 84, 3537-3551 |
4020091 | CIF | C11 H8 Cl N5 | P -1 | 9.9826; 14.2394; 15.8551 100.842; 106.831; 97.898 | 2074.1 | Unciti-Broceta, A.; Pineda-de-las-Infantas, M.J.; Díaz-Mochón, J.J.; Romagnoli, R.; Baraldi, P.G.; Gallo, M.A.; Espinosa, A. Journal of Organic Chemistry, 2005, 70, 2878-2880 |
4038365 | CIF | C11 H8 Cl2 F3 N2 O3 P S | P 1 21/n 1 | 12.7884; 5.86021; 21.1423 90; 107.479; 90 | 1511.3 | Schoemaker, Robin; Schwedtmann, Kai; Hennersdorf, Felix; Bauzá, Antonio; Frontera, Antonio; Weigand, Jan J. Toward N,P-Doped π-Extended PAHs: A One-Pot Synthesis to Diannulated 1,4,2-Diazaphospholium Triflate Salts. The Journal of organic chemistry, 2020 |
4038926 | CIF | C11 H8 Cl2 O3 | P 21 21 21 | 9.0147; 10.9941; 11.1906 90; 90; 90 | 1109.08 | Norseeda, Krissada; Chaisan, Nattawadee; Thongsornkleeb, Charnsak; Tummatorn, Jumreang; Ruchirawat, Somsak Correction to "Metal-Free Synthesis of 4-Chloroisocoumarins by TMSCl-Catalyzed NCS-Induced Chlorinative Annulation of 2-Alkynylaryloate Esters". The Journal of organic chemistry, 2020 |
4038371 | CIF | C11 H8 Cl4 F3 N2 O3 P S | P 1 n 1 | 9.33396; 8.28139; 11.25557 90; 109.401; 90 | 820.629 | Schoemaker, Robin; Schwedtmann, Kai; Hennersdorf, Felix; Bauzá, Antonio; Frontera, Antonio; Weigand, Jan J. Toward N,P-Doped π-Extended PAHs: A One-Pot Synthesis to Diannulated 1,4,2-Diazaphospholium Triflate Salts. The Journal of organic chemistry, 2020 |
4034704 | CIF | C11 H8 F N O3 | P 1 21/c 1 | 23.1591; 5.7258; 7.1647 90; 94.102; 90 | 947.64 | Serebryannikova, Anna V.; Galenko, Ekaterina E.; Novikov, Mikhail Sergeevich; Khlebnikov, Alexander F. Synthesis of Isoxazole- and Oxazole-4-carboxylic Acids Derivatives by Controlled Isoxazole-Azirine-Isoxazole/Oxazole Isomerization. The Journal of organic chemistry, 2019 |
4030748 | CIF | C11 H8 F3 N O2 S2 | P 1 21/c 1 | 13.839; 11.892; 7.497 90; 99.943; 90 | 1215.3 | Shao, Xinxin; Xu, Chunfa; Lu, Long; Shen, Qilong Structure-reactivity relationship of trifluoromethanesulfenates: discovery of an electrophilic trifluoromethylthiolating reagent. The Journal of organic chemistry, 2015, 80, 3012-3021 |
4038375 | CIF | C11 H8 F3 N2 O3 P S | P -1 | 7.2241; 9.0577; 10.9162 95.055; 99.126; 109.45 | 657.34 | Schoemaker, Robin; Schwedtmann, Kai; Hennersdorf, Felix; Bauzá, Antonio; Frontera, Antonio; Weigand, Jan J. Toward N,P-Doped π-Extended PAHs: A One-Pot Synthesis to Diannulated 1,4,2-Diazaphospholium Triflate Salts. The Journal of organic chemistry, 2020 |
4038367 | CIF | C11 H8 F7 N2 O3 P S | P 1 n 1 | 8.73091; 7.86576; 11.09899 90; 110.593; 90 | 713.521 | Schoemaker, Robin; Schwedtmann, Kai; Hennersdorf, Felix; Bauzá, Antonio; Frontera, Antonio; Weigand, Jan J. Toward N,P-Doped π-Extended PAHs: A One-Pot Synthesis to Diannulated 1,4,2-Diazaphospholium Triflate Salts. The Journal of organic chemistry, 2020 |
4032457 | CIF | C11 H8 N2 | P 21 21 21 | 5.844; 9.814; 14.4195 90; 90; 90 | 827.002 | Yan, Qiao; Gin, Emma; Banwell, Martin G.; Willis, Anthony C.; Carr, Paul D. A Unified Approach to the Isomeric α-, β-, γ-, and δ-Carbolines via their 6,7,8,9-Tetrahydro Counterparts. The Journal of organic chemistry, 2017, 82, 4328-4335 |
4032458 | CIF | C11 H8 N2 | I 1 a 1 | 12.1155; 3.9036; 18.1199 90; 107.25; 90 | 818.42 | Yan, Qiao; Gin, Emma; Banwell, Martin G.; Willis, Anthony C.; Carr, Paul D. A Unified Approach to the Isomeric α-, β-, γ-, and δ-Carbolines via their 6,7,8,9-Tetrahydro Counterparts. The Journal of organic chemistry, 2017, 82, 4328-4335 |
4032460 | CIF | C11 H8 N2 | P 1 21/n 1 | 11.1814; 5.53776; 13.4546 90; 96.2939; 90 | 828.09 | Yan, Qiao; Gin, Emma; Banwell, Martin G.; Willis, Anthony C.; Carr, Paul D. A Unified Approach to the Isomeric α-, β-, γ-, and δ-Carbolines via their 6,7,8,9-Tetrahydro Counterparts. The Journal of organic chemistry, 2017, 82, 4328-4335 |
4032670 | CIF | C11 H8 N2 | P n a 21 | 17.1576; 12.2955; 3.8213 90; 90; 90 | 806.15 | Yan, Qiao; Gin, Emma; Banwell, Martin G.; Willis, Anthony C.; Carr, Paul D. A Unified Approach to the Isomeric α-, β-, γ-, and δ-Carbolines via their 6,7,8,9-Tetrahydro Counterparts. The Journal of organic chemistry, 2017, 82, 4328-4335 |
4037689 | CIF | C11 H8 N2 | P 21 21 21 | 5.845; 10.0578; 14.217 90; 90; 90 | 835.79 | Bolte, Benoit; Bryan, Christopher S.; Sharp, Phillip P.; Sayyahi, Soheil; Rihouey, Charly; Kendrick, Amy; Lan, Ping; Banwell, Martin G.; Jackson, Colin J.; Fraser, Nicholas J.; Willis, Anthony C.; Ward, James S. Total Syntheses of the 3H-Pyrrolo[2,3-c]quinolone-containing Alkaloids Marinoquinolines A-F, K and Aplidiopsamine A Using a Palladium-catalysed Ullmann Cross-coupling/Reductive Cyclization Pathway. The Journal of organic chemistry, 2019 |
4034105 | CIF | C11 H8 N2 O S | P 1 21/c 1 | 7.4512; 10.1767; 13.2955 90; 94.481; 90 | 1005.1 | Veltri, Lucia; Amuso, Roberta; Cuocci, Corrado; Vitale, Paola; Gabriele, Bartolo Palladium-Catalyzed Cyclocarbonylation Approach to Thiadiazafluorenones: A Correction. The Journal of organic chemistry, 2019, 84, 8743-8749 |
4020924 | CIF | C11 H8 N4 S | P -1 | 8.4404; 12.304; 20.759 80.261; 81.795; 85.807 | 2100.5 | Józef Zienkiewicz; Piotr Kaszynski; Victor G. Young, Jr. Fused-Ring Thiadiazines: Preparation and Crystallographic Characterization of 3-Phenyl Derivative of Benzo-, Pyridio[2,3-e]-, Pyrazino[2,3-e]-, and Tetrafluorobenzo-[1,2,4]thiadiazines Journal of Organic Chemistry, 2004, 69, 2551-2561 |
4034195 | CIF | C11 H8 N4 S | P 1 21/c 1 | 11.113; 7.1958; 12.597 90; 93.19; 90 | 1005.8 | Bandaru, Siva Sankar Murthy; Bhilare, Shatrughn; Cardozo, Jesvita; Chrysochos, Nicolas; Schulzke, Carola; Sanghvi, Yogesh S.; Gunturu, Krishna Chaitanya; Kapdi, Anant R. Pd/PTABS: Low-Temperature Thioetherification of Chloro(hetero)arenes. The Journal of organic chemistry, 2019, 84, 8921-8940 |
4033972 | CIF | C11 H8 O4 | P 1 21/c 1 | 11.629; 6.594; 11.819 90; 92.98; 90 | 905.1 | Pilevar, Afsaneh; Hosseini, Abolfazl; Becker, Jonathan; Schreiner, Peter R. Syn-Dihydroxylation of Alkenes Using a Sterically Demanding Cyclic Diacyl Peroxide. The Journal of organic chemistry, 2019, 84, 12377-12386 |
4032946 | CIF | C11 H9 B F2 N2 O2 S | C 1 2/c 1 | 30.4109; 4.9043; 18.0383 90; 122.921; 90 | 2258.3 | Sasano, Yoshifumi; Sato, Ryuma; Shigeta, Yasuteru; Yasuda, Nobuhiro; Maeda, Hiromitsu H-Aggregated π-Systems Based on Disulfide-Linked Dimers of Dipyrrolyldiketone Boron Complexes. The Journal of organic chemistry, 2017, 82, 11166-11172 |
4025114 | CIF | C11 H9 Br N2 O | P 1 21/c 1 | 9.8704; 5.8208; 17.713 90; 100.994; 90 | 999 | Oxana Ryabtsova; Tom Verhelst; Mattijs Baeten; Christophe M. L. Vande Velde; Bert U. W. Maes Synthesis of Functionalized Pyridazin-3(2H)-ones via Bromine-Magnesium Exchange on Bromopyridazin-3(2H)-ones Journal of Organic Chemistry, 2009, 74, 9440-9445 |
4020087 | CIF | C11 H9 Br O | P 1 21/c 1 | 10.7665; 11.2765; 7.9422 90; 100.695; 90 | 947.5 | Gottschling, Stephen E.; Grant, Tina N.; Milnes, Kaarina K.; Jennings, Michael, C.; Baines, Kim M. Cyclopropyl Alkynes as Mechanistic Probes to Distinguish Between Vinyl Radical and Ionic Intermediates Journal of Organic Chemistry, 2005, 70, 2686-2695 |
4029232 | CIF | C11 H9 Cl F4 N2 O S | P 31 | 10.278; 10.278; 11.406 90; 90; 120 | 1043.5 | Yang, Kai; Liu, Li-Juan; Liu, Jin-Tao The synthesis and strecker reaction of 2-chlorotetrafluoroethanesulfinyl ketimines. The Journal of organic chemistry, 2014, 79, 3215-3220 |
4028817 | CIF | C11 H9 Cl N2 O | P 1 21/n 1 | 18.014; 11.966; 25.055 90; 98.57; 90 | 5340.44 | Xiaoqing Xin; Dexuan Xiang; Jiming Yang; Qian Zhang; Fenguo Zhou; Dewen Dong Homogeneous and Stereoselective Copper(II)-Catalyzed Monohydration of Methylenemalononitriles to 2-Cyanoacrylamides Journal of Organic Chemistry, 2013, 78, 11956-11961 |
4035732 | CIF | C11 H9 Cl N2 O2 | P 1 21/c 1 | 9.6161; 9.1313; 12.11 90; 98.97; 90 | 1050.3 | Bhilare, Shatrughn; Murthy Bandaru, Siva Sankar; Shah, Jagrut; Chrysochos, Nicolas; Schulzke, Carola; Sanghvi, Yogesh S.; Kapdi, Anant R. Pd/PTABS: Low Temperature Etherification of Chloroheteroarenes. The Journal of organic chemistry, 2018, 83, 13088-13102 |
4025981 | CIF | C11 H9 Cl N2 O4 | P -1 | 7.6607; 7.7335; 10.9132 106.496; 96.783; 106.6 | 579.96 | Mustafa J. Raihan; Veerababurao Kavala; Pateliya Mujjamil Habib; Qiao-Zhi Guan; Chun-Wei Kuo; Ching-Fa Yao Synthesis of Isoxazoline N-Oxides via [Hydroxy(tosyloxy)iodo]benzene (HTIB)-Mediated Oxidative N-O Coupling Journal of Organic Chemistry, 2011, 76, 424-434 |
4031292 | CIF | C11 H9 Cl N4 O2 | P 1 21/n 1 | 9.7969; 8.3719; 14.3309 90; 108.517; 90 | 1114.55 | Lee, Mijoon; Rucil, Tomas; Hesek, Dusan; Oliver, Allen G.; Fisher, Jed F.; Mobashery, Shahriar Regioselective Control of the SNAr Amination of 5-Substituted-2,4-Dichloropyrimidines Using Tertiary Amine Nucleophiles. The Journal of organic chemistry, 2015, 80, 7757-7763 |
4020325 | CIF | C11 H9 Cl3 Cu N2 | C 1 2/c 1 | 21.008; 8.111; 15.895 90; 99.683; 90 | 2670 | Fabian Mohr; Seth A. Binfield; James C. Fettinger; Andrei N. Vedernikov Journal of Organic Chemistry, 2005, 70, 4833-4839 |
4029186 | CIF | C11 H9 Cl3 O | P 1 21/n 1 | 10.463; 12.044; 10.74 90; 118.36; 90 | 1191 | Lin, Mei-Huey; Huang, Yen-Chih; Kuo, Chung-Kai; Tsai, Chang-Hsien; Li, Yi-Syuan; Hu, Ting-Chia; Chuang, Tsung-Hsun γ-Halo-enones: A Method for their Synthesis from Arylacyl Halides and Their Application to the Preparation of Five-Membered Ring Heterocycles. The Journal of organic chemistry, 2014, 79, 2751-2757 |
4035286 | CIF | C11 H9 F2 N O3 | P 1 21 1 | 6.9994; 10.6106; 7.0797 90; 99.157; 90 | 519.09 | Xi, Ning; Sun, Xiaohua; Li, Minxiong; Sun, Mingming; Xi, Michael A.; Zhan, Zeping; Yao, Jia; Bai, Xu; Wu, Yanjun; Liao, Min Noncovalent Interactions of Fluorine with Amide and CH<sub>2</sub> Groups in N-Phenyl γ-Lactams: Covalently Identical Fluorine Atoms in Nonequivalent Chemical Environments. The Journal of organic chemistry, 2018, 83, 11586-11594 |
4024674 | CIF | C11 H9 F2 N3 O | P -1 | 5.5843; 7.7332; 23.7937 95.333; 95.092; 90.95 | 1018.71 | Graham Pattison; Graham Sandford; Dmitry S. Yufit; Judith A. K. Howard; John A. Christopher; David D. Miller Polysubstituted Pyridazinones from Sequential Nucleophilic Substitution Reactions of Tetrafluoropyridazine Journal of Organic Chemistry, 2009, 74, 5533-5540 |
4023716 | CIF | C11 H9 F3 O4 S | P b c a | 7.8398; 10.5404; 29.6581 90; 90; 90 | 2450.79 | Simon Specklin; Philippe Bertus; Jean-Marc Weibel; Patrick Pale A Versatile and Highly Stereoselective Access to Vinyl Triflates Derived from 1,3-Dicarbonyl and Related Compounds Journal of Organic Chemistry, 2008, 73, 7845-7848 |
4027765 | CIF | C11 H9 I O2 | P 1 21/c 1 | 14.847; 10.857; 14.834 90; 119.32; 90 | 2084.8 | Anna Antos; Yiannis Elemes; Adonis Michaelides; John, A. Nyxas; Stavroula Skoulika; Lazaros P. Hadjiarapoglou The Question of Electrophilic vs Nucleophilic Addition of Cyclic β-Dicarbonyl Phenyliodonium Ylides: Electrophilic Cycloaddition of Diphenylketene Journal of Organic Chemistry, 2012, 77, 10949-10954 |
4020828 | CIF | C11 H9 I O3 | P 1 21/n 1 | 12.9; 7.216; 13.626 90; 116.23; 90 | 1137.8 | Shengming Ma; Bin Wu; Zhangjie Shi An Efficient Synthesis of 4-Halo-5-hydroxyfuran-2(5H)-ones via the Sequential Halolactonization and γ-Hydroxylation of 4-Aryl-2,3-alkadienoic Acids Journal of Organic Chemistry, 2004, 69, 1429-1431 |
4021746 | CIF | C11 H9 N O | P 1 21/n 1 | 9.0507; 6.9774; 14.452 90; 103.996; 90 | 885.6 | Cristiano Raminelli; Zhijian Liu; Richard C. Larock Regioselective Synthesis of 3-(2-Hydroxyaryl)pyridines via Arynes and Pyridine N-Oxides Journal of Organic Chemistry, 2006, 71, 4689-4691 |
4024365 | CIF | C11 H9 N O2 S | P 1 21/c 1 | 7.3446; 11.9258; 11.857 90; 95.691; 90 | 1033.44 | Leo A. Paquette; Robert D. Dura; Isabelle Modolo Contrasting Responses of Pyrido[2,1-a]isoindol-6-ones and Their Sultam Counterparts to Photochemical Activation Journal of Organic Chemistry, 2009, 74, 1982-1987 |
4029013 | CIF | C11 H9 N O3 S | P 1 21/c 1 | 12.5682; 7.3873; 11.2454 90; 98.128; 90 | 1033.59 | Chen, Chih-Yuan; Bocian, David F.; Lindsey, Jonathan S. Synthesis of 24 Bacteriochlorin Isotopologues, Each Containing a Symmetrical Pair of (13)C or (15)N Atoms in the Inner Core of the Macrocycle. The Journal of organic chemistry, 2014, 79, 1001 |
4032477 | CIF | C11 H9 N3 O | P 1 21/c 1 | 10.3149; 6.163; 16.152 90; 105.452; 90 | 989.7 | Ding, Xiaomei; Huang, Manna; Yi, Zhou; Du, Dongchen; Zhu, Xinhai; Wan, Yiqian Room-Temperature CuI-Catalyzed Amination of Aryl Iodides and Aryl Bromides. The Journal of organic chemistry, 2017, 82, 5416-5423 |
4038792 | CIF | C11 H9 N3 O | P -1 | 7.073; 8.1167; 8.7016 86.895; 81.037; 71.308 | 467.42 | Wang, Jian; Li, Jiang-Hua; Guo, Yidong; Dong, Hongbo; Liu, Qiang; Yu, Xiao-Qi TEMPO-Mediated C-H Amination of Benzoxazoles with N-Heterocycles. The Journal of organic chemistry, 2020, 85, 12797-12803 |
4023247 | CIF | C11 H9 N3 O2 | P 21 21 21 | 4.5573; 10.7409; 21.1615 90; 90; 90 | 1035.84 | John Kallikat Augustine; Yanjerappa Arthoba Naik; Ashis Baran Mandal; Umesha Kundapur An Unusual Reaction of Benzalaminoacetals in Trifluoroacetic Acid: Facile Synthesis of 2-Benzylpyrazines Journal of Organic Chemistry, 2008, 73, 1176-1179 |
4032785 | CIF | C11 H9 N3 O3 | P 1 21/c 1 | 9.1992; 4.6213; 25.2188 90; 93.384; 90 | 1070.24 | Huang, Adrian; Wo, Kellie; Lee, So Yeun Christine; Kneitschel, Nika; Chang, Jennifer; Zhu, Kathleen; Mello, Tatsiana; Bancroft, Laura; Norman, Natalie J.; Zheng, Shao-Liang Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles. The Journal of organic chemistry, 2017, 82, 8864-8872 |
4035440 | CIF | C11 H9 N5 O3 | P -1 | 7.3874; 8.0591; 10.8556 96.711; 104.962; 105.019 | 591.25 | Atienza, Bren Jordan P.; Jensen, Lionel D.; Noton, Sarah L.; Ansalem, Anil Kumar Victoria; Hobman, Tom; Fearns, Rachel; Marchant, David J.; West, F. G. Dual Catalytic Synthesis of Antiviral Compounds Based on Metallocarbene-Azide Cascade Chemistry. The Journal of organic chemistry, 2018, 83, 6829-6842 |
4022741 | CIF | C11.25 H16.25 Cl0.75 O | I -4 | 16.5954; 16.5954; 8.2166 90; 90; 90 | 2262.9 | Daniele Casarini; Lodovico Lunazzi; Michele Mancinelli; Andrea Mazzanti Conformation and Stereodynamics of Symmetrically Ortho-Disubstituted Aryl Carbinols and Aryl Ethers Journal of Organic Chemistry, 2007, 72, 998-1004 |
4033173 | CIF | C11.25 H19.5 Cl0.5 N O4 | P -1 | 10.3698; 11.4667; 12.0264 65.754; 80.975; 85.855 | 1287.7 | Bulman Page, Philip C.; Goodyear, Ross L.; Horton, Alexandra E.; Chan, Yohan; Karim, Rehana; O'Connell, Maria A; Hamilton, Christopher; Slawin, Alexandra M. Z.; Buckley, Benjamin R.; Allin, Steven M. Formal Total Synthesis of (+)-C9-Deoxyomuralide from l-Leucine Using a Double Sacrificial Chirality Transfer Approach. The Journal of organic chemistry, 2017, 82, 12209-12223 |
4033890 | CIF | C11.99 H11.96 I1.01 N O2 S | P b c a | 6.3705; 16.0873; 25.9006 90; 90; 90 | 2654.4 | Wang, Pengzhi; Chau Nguyen, Khiem; Lindsey, Jonathan S. Synthesis of the Ring C Pyrrole of Native Chlorophylls and Bacteriochlorophylls. The Journal of organic chemistry, 2019, 84, 11286-11293 |
4036253 | CIF | C110 H114 N9 O39 | P 1 21 1 | 10.7088; 44.986; 11.2096 90; 91.109; 90 | 5399.2 | Shao, Chang-Lun; Linington, Roger G.; Balunas, Marcy J.; Centeno, Argelis; Boudreau, Paul; Zhang, Chen; Engene, Niclas; Spadafora, Carmenza; Mutka, Tina S.; Kyle, Dennis E.; Gerwick, Lena; Wang, Chang-Yun; Gerwick, William H. Bastimolide A, a Potent Antimalarial Polyhydroxy Macrolide from the Marine Cyanobacterium Okeania hirsuta. The Journal of organic chemistry, 2015, 80, 7849-7855 |
4025960 | CIF | C110 H124 N12 O19.5 | P 1 21 1 | 13.94; 13.983; 52.858 90; 90.15; 90 | 10303 | Amol M. Kendhale; Legiso Poniman; Zeyuan Dong; Katta Laxmi-Reddy; Brice Kauffmann; Yann Ferrand; Ivan Huc Absolute Control of Helical Handedness in Quinoline Oligoamides Journal of Organic Chemistry, 2011, 76, 195-200 |
4021235 | CIF | C110 H130 N4 O4 | P 1 21/c 1 | 22.669; 20.1; 23.474 90; 118.169; 90 | 9429 | Jonathan P. Hill; Ian J. Hewitt; Christopher E. Anson; Annie K. Powell; Amy Lea McCarty; Paul A. Karr; Melvin E. Zandler; Francis D'Souza Highly Nonplanar, Electron Deficient, N-Substituted tetra-Oxocyclohexadienylidene Porphyrinogens: Structural, Computational, and Electrochemical Investigations Journal of Organic Chemistry, 2004, 69, 5861-5869 |
4023005 | CIF | C110 H136 Cl2 F4 N14 O4 | P 1 21/n 1 | 15.5448; 23.8432; 29.1057 90; 96.448; 90 | 10719.4 | Kenichi Calderon-Kawasaki; Sumith Kularatne; Yue Hu Li; Bruce C. Noll; W. Robert Scheidt; Dennis H. Burns Synthesis of Urea Picket Porphyrins and Their Use in the Elucidation of the Role Buried Solvent Plays in the Selectivity and Stoichiometry of Anion Binding Receptors Journal of Organic Chemistry, 2007, 72, 9081-9087 |
4032960 | CIF | C110 H140 O10 | C 1 2/c 1 | 43.045; 21.347; 23.043 90; 104.773; 90 | 20474 | Al-Azemi, Talal F; Vinodh, Mickey; Alipour, Fatemeh H.; Mohamod, Abdirahman A. Constitutional Isomers of Pentahydroxy-Functionalized Pillar[5]arenes: Synthesis, Characterization, and Crystal Structures. The Journal of organic chemistry, 2017, 82, 10945-10952 |
4024508 | CIF | C110 H172 Cl20 N8 O12 P8 Pt4 | P -1 | 10.7455; 18.3338; 19.2355 78.1129; 86.5602; 79.1068 | 3640.55 | Yao-Rong Zheng; Brian H Northrop; Hai-Bo Yang; Liang Zhao; Peter J. Stang Geometry Directed Self-Selection in the Coordination-Driven Self-Assembly of Irregular Supramolecular Polygons Journal of Organic Chemistry, 2009, 74, 3554-3557 |
4034253 | CIF | C110.82 H123.23 N8.41 O8 | P 1 21 1 | 11.242; 40.833; 11.278 90; 111.848; 90 | 4805.3 | Wellhöfer, Isabelle; Frydenvang, Karla; Kotesova, Simona; Christiansen, Andreas M.; Laursen, Jonas S.; Olsen, Christian A. Functionalized Helical β-Peptoids. The Journal of organic chemistry, 2019, 84, 3762-3779 |
4024177 | CIF | C111 H114 N21 O10 P | P -1 | 21.414; 23.166; 24.601 88.98; 78.128; 84.935 | 11896 | Evgeny A. Katayev; Jonathan L. Sessler; Victor N. Khrustalev; Yuri A. Ustynyuk Synthetic Model of the Phosphate Binding Protein: Solid-State Structure and Solution-Phase Anion Binding Properties of a Large Oligopyrrolic Macrocycle Journal of Organic Chemistry, 2007, 72, 7244-7252 |
4021997 | CIF | C111 H115 F9 N20 O23 | P -1 | 10.6083; 21.8311; 24.3418 86.317; 89.074; 83.529 | 5589.6 | Elizabeth R. Gillies; Christel Dolain; Jean-Michel Léger; Ivan Huc Amphipathic Helices from Aromatic Amino Acid Oligomers Journal of Organic Chemistry, 2006, 71, 7931-7939 |
4034206 | CIF | C111 H150 Br8 Cl11 N17 O28 | P 1 21/n 1 | 13.3373; 17.9188; 57.9576 90; 93.081; 90 | 13831.2 | Huang, Wen-Long; Wang, Xu-Dong; Li, Sen; Zhang, Rui; Ao, Yu-Fei; Tang, Jun; Wang, Qi-Qiang; Wang, De-Xian Anion Transporters Based on Noncovalent Balance including Anion-π, Hydrogen, and Halogen Bonding. The Journal of organic chemistry, 2019, 84, 8859-8869 |
4036589 | CIF | C111 H171 B12 Cl9 N12 | R -3 :H | 17.318; 17.318; 34.804 90; 90; 120 | 9040 | Wakabayashi, Shigeharu; Hori, Yuka; Komeda, Seiji; Shimizu, Yuki; Ohki, Yasuhiro; Horiuchi, Misaki; Itoh, Takahito; Sugihara, Yoshikazu; Tatsumi, Kazuyuki Self-Assembly of 4-(Diethylboryl)pyridine: Crystal Structures of the Cyclic Pentamer and Hexamer and Their Solvent-Dependent Selective Crystallization. The Journal of organic chemistry, 2016, 81, 2399-2404 |
4036878 | CIF | C111.3 H139.9 N8 O58.5 S4.65 | P 1 | 11.3435; 15.0588; 20.0689 105.66; 100.493; 99.598 | 3160.2 | Lichosyt, Dawid; Wasiłek, Sylwia; Jurczak, Janusz Exploring the Chiral Recognition of Carboxylates by C2-Symmetric Receptors Bearing Glucosamine Pendant Arms. The Journal of organic chemistry, 2016, 81, 7342-7348 |
4023718 | CIF | C111.5 H136.25 F12 K2 N14.75 O22 P2 | P -1 | 14.386; 14.858; 29.807 88.545; 87.286; 66.908 | 5854 | Tao Han; Chuan-Feng Chen Efficient Potassium-Ion-Templated Synthesis and Controlled Destruction of [2]Rotaxanes Based on Cascade Complexes Journal of Organic Chemistry, 2008, 73, 7735-7742 |
4022175 | CIF | C111.75 H134.5 Cl5.5 N3 O8 | P -1 | 21.979; 22.02; 26.603 107.85; 94.8; 119.6 | 10217.2 | Xianshun Zeng; Andrei S. Batsanov; Martin R. Bryce Calix[6]arene Derivatives Selectively Functionalized at Alternate Sites on the Smaller Rim with 2-Phenylpyridine and 2-Fluorenylpyridine Substituents to Provide Deep Cavities Journal of Organic Chemistry, 2006, 71, 9589-9594 |
4024095 | CIF | C112 H120 N4 O16 S2 | P -1 | 13.3598; 18.5652; 23.1445 71.668; 84.352; 77.554 | 5318.2 | Seung-Doo Jeong; Seong-Jin Hong; Kee Jong Park; Sihyun Ham; Jonathan L. Sessler; Vincent Lynch; Chang-Hee Lee Core-Modified, meso-Alkylidenyl Porphyrins and Their Expanded Analogues: A New Family of Nonplanar Porphyrinoids Journal of Organic Chemistry, 2007, 72, 6232-6240 |
4025220 | CIF | C112 H125 N9 O5 | P -1 | 16.998; 17.548; 19.521 76.506; 70.271; 85.488 | 5329.6 | Eva M. García-Frutos; Gunther Hennrich; Enrique Gutierrez; Angeles Monge; Berta Gómez-Lor Self-Assembly of C3-Symmetrical Hexaaryltriindoles Driven by Solvophobic and CH-π Interactions Journal of Organic Chemistry, 2010, 75, 1070-1076 |
4026666 | CIF | C112 H134 B2 Li2 N6 O8 | P -1 | 13.9077; 14.6294; 14.6476 67.2543; 74.2008; 72.7007 | 2581.91 | Bret R. Van Ausdall; Nils F. Poth; Virginia A. Kincaid; Atta M. Arif; Janis Louie Imidazolidene Carboxylate Bound MBPh4 Complexes (M = Li, Na) and Their Relevance in Transcarboxylation Reactions Journal of Organic Chemistry, 2011, 76, 8413-8420 |
4028121 | CIF | C112 H134 F24 N10 O20 P4 | P -1 | 13.4033; 15.6426; 17.7463 66.405; 87.465; 66.34 | 3092.9 | Ying Han; Jing Cao; Peng-Fei Li; Qian-Shou Zong; Jian-Min Zhao; Jia-Bin Guo; Jun-Feng Xiang; Chuan-Feng Chen Complexation of Triptycene-Derived Macrotricyclic Polyether with Paraquat Derivatives, Diquat, and a 2,7-Diazapyrenium Salt: Guest-Induced Conformational Changes of the Host Journal of Organic Chemistry, 2013, 78, 3235-3242 |
4038799 | CIF | C112 H136 Cl12 O6 | P -1 | 12.338; 15.813; 15.886 62.331; 80.881; 68.02 | 2545 | Iuliano, Veronica; Talotta, Carmen; Gaeta, Carmine; Hickey, Neal; Geremia, Silvano; Vatsouro, Ivan; Kovalev, Vladimir; Neri, Placido Influence of <i>exo</i>-Adamantyl Groups and <i>endo</i>-OH Functions on the Threading of Calix[6]arene Macrocycle. The Journal of organic chemistry, 2020, 85, 12585-12593 |
4025548 | CIF | C112 H136 F12 N6 O20 P2 | P -1 | 11.658; 14.2365; 18.3424 75.379; 77.397; 68.116 | 2707.2 | Jian-Min Zhao; Qian-Shou Zong; Chuan-Feng Chen Complexation of Triptycene-Based Macrotricyclic Host toward (9-Anthracylmethyl)benzylammonium Salt: A Ba2+ Selective Fluorescence Probe Journal of Organic Chemistry, 2010, 75, 5092-5098 |
4026728 | CIF | C112 H176 Cl16 N64 | C 1 2/c 1 | 12.516; 24.947; 12.942 90; 116.07; 90 | 3629.8 | Brendan Kelly; Daniel H. O'Donovan; John O'Brien; Thomas McCabe; Fernando Blanco; Isabel Rozas Pyridin-2-yl Guanidine Derivatives: Conformational Control Induced by Intramolecular Hydrogen-Bonding Interactions Journal of Organic Chemistry, 2011, 76, 9216-9227 |
4024984 | CIF | C113 H112 | P 1 2/n 1 | 27.309; 16.35; 39.232 90; 100.78; 90 | 17208 | Jarugu Narasimha Moorthy; Palani Natarajan; Paloth Venugopalan Abundant Lattice Inclusion Phenomenon with Sterically Hindered and Inherently Shape-Selective Tetraarylpyrenes Journal of Organic Chemistry, 2009, 74, 8566-8577 |
4038952 | CIF | C113 H16 N12 S12 | P a -3 | 19.504; 19.504; 19.504 90; 90; 90 | 7419.4 | Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Molecular Organization of 2,1,3-Benzothiadiazoles in the Solid State. The Journal of organic chemistry, 2017, 82, 5034-5045 |
4033738 | CIF | C113 H82 Cu2 N4 O7 P4 | P 1 21/c 1 | 13.5237; 21.5116; 16.3696 90; 97.649; 90 | 4719.8 | Mondal, Sandip; Bera, Sachinath; Ghosh, Prasanta Redox Cascades and Making of a C-C Bond: 1,2-Benzodiazinyl Radicals and a Copper Complex of a Benzodiazine. The Journal of organic chemistry, 2019, 84, 1871-1881 |
4023657 | CIF | C114 H115 F12 N5 O16 P2 | P 1 21/n 1 | 20.274; 20.198; 29.295 90; 107.146; 90 | 11464 | Jian-Min Zhao; Qian-Shou Zong; Tao Han; Jun-Feng Xiang; Chuan-Feng Chen Guest-Dependent Complexation of Triptycene-Based Macrotricyclic Host with Paraquat Derivatives and Secondary Ammonium Salts: A Chemically Controlled Complexation Process Journal of Organic Chemistry, 2008, 73, 6800-6806 |
4033259 | CIF | C114 H120 I N2 O2 Yb | P 1 21/n 1 | 17.7803; 25.6504; 20.8183 90; 92.2807; 90 | 9487.1 | Wang, Weifan; Shen, Xingchao; Zhao, Fengyi; Jiang, Huan; Yao, Weiwei; Pullarkat, Sumod A.; Xu, Li; Ma, Mengtao Ytterbium-Catalyzed Hydroboration of Aldehydes and Ketones. The Journal of organic chemistry, 2017 |
4036230 | CIF | C114 H134 F12 N2 O26 P2 | P 1 21/c 1 | 12.6946; 30.8143; 18.2906 90; 93.275; 90 | 7143.1 | Hu, Wei-Bo; Xie, Chang-Dong; Hu, Wen-Jing; Zhao, Xiao-Li; Liu, Yahu A.; Huo, Ji-Chuan; Li, Jiu-Sheng; Jiang, Biao; Wen, Ke Selectivity and Cooperativity in the Binding of Multiple Guests to a Pillar[5]arene-Crown Ether Fused Tricyclic Host. The Journal of organic chemistry, 2015, 80, 7994-8000 |
4028617 | CIF | C114 H136 O8 S4 | P -1 | 19.0813; 20.9562; 27.535 69.762; 81.598; 74.116 | 9920.1 | Hemant Gopee; Xiangfei Kong; Zhiqun He; Isabelle Chambrier; David L. Hughes; Graham J. Tizzard; Simon J. Coles; Andrew N. Cammidge Expanded Porphyrin-like Structures Based on Twinned Triphenylenes Journal of Organic Chemistry, 2013, 78, 9505-9511 |
4034288 | CIF | C114 H162 Cl6 N10 O13 | P n a 21 | 25.208; 16.8924; 26.912 90; 90; 90 | 11459.8 | Liu, Wenqi; Oliver, Allen G.; Smith, Bradley D. Stabilization and Extraction of Fluoride Anion Using a Tetralactam Receptor. The Journal of organic chemistry, 2019, 84, 4050-4057 |
4023545 | CIF | C114 H224 N10 O101 | P 1 21 1 | 15.6068; 20.806; 23.361 90; 91.114; 90 | 7584.4 | Yu Liu; Zi-Xin Yang; Yong Chen Syntheses and Self-Assembly Behaviors of the Azobenzenyl Modified β-Cyclodextrins Isomers Journal of Organic Chemistry, 2008, 73, 5298-5304 |
4035760 | CIF | C115 H152 Cl2 F N16 | P 1 21/m 1 | 11.409; 44.6389; 21.1247 90; 101.254; 90 | 10551.6 | Molina-Muriel, Ricardo; Aragay, Gemma; Escudero-Adán, Eduardo C; Ballester, Pablo Switching from Negative-Cooperativity to No-Cooperativity in the Binding of Ion-Pair Dimers by a Bis(calix[4]pyrrole) Macrocycle. The Journal of organic chemistry, 2018, 83, 13507-13514 |
4038006 | CIF | C116 H104 B2 F8 N4 Pd | P -1 | 9.1474; 21.215; 26.637 106.603; 96.033; 100.512 | 4802.3 | Duong, Adam; Levesque, Alexandre; Homand, Clara; Maris, Thierry; Wuest, James D. Controlling Molecular Organization by Using Phenyl Embraces of Multiple Trityl Groups. The Journal of organic chemistry, 2020 |
4026878 | CIF | C116 H208 N48 O61 | P 1 21/c 1 | 12.6912; 12.5739; 23.0762 90; 98.67; 90 | 3640.4 | Feng Wu; Li-Hui Wu; Xin Xiao; Yun-Qian Zhang; Sai-Feng Xue; Zhu Tao; Anthony I. Day Locating the Cyclopentano Cousins of the Cucurbit[n]uril Family Journal of Organic Chemistry, 2012, 77, 606-611 |
4027915 | CIF | C116 H96 O12 | C 1 2/c 1 | 21.7; 10.919; 21.173 90; 118.59; 90 | 4405 | Tao Wang; Yu-Fei Zhang; Qin-Qing Hou; Wen-Rong Xu; Xiao-Ping Cao; Hak-Fun Chow; Dietmar Kuck C3-Symmetrical Tribenzotriquinacene Derivatives: Optical Resolution through Cryptophane Synthesis and Supramolecular Self-Assembly into Nanotubes Journal of Organic Chemistry, 2013, 78, 1062-1069 |
4032847 | CIF | C117 H126 N14 O52 | P -1 | 12.2639; 12.7251; 22.7496 87.293; 87.843; 79.827 | 3489 | Chakraborty, Sourav; Saha, Subrata; Lima, Luís M P; Warzok, Ulrike; Sarkar, Sayan; Akhuli, Bidyut; Nandi, Mandira; Bej, Somnath; Adarsh, Nayarassery N.; Schalley, Christoph A.; Delgado, Rita; Ghosh, Pradyut Polyamide-Polyamine Cryptand as Dicarboxylate Receptor: Dianion Binding Studies in the Solid State, in Solution, and in the Gas Phase. The Journal of organic chemistry, 2017, 82, 10007-10014 |
4020400 | CIF | C117 H149 Cl2 N5 O8 S8 | P 21 21 21 | 12.9144; 23.419; 38.574 90; 90; 90 | 11666.4 | Bang-Tun Zhao; María-Jesús Blesa; Nicolas Mercier; Franck Le Derf; Marc Sallé Journal of Organic Chemistry, 2005, 70, 6254-6257 |
4025605 | CIF | C117 H210 Cl6 N32 Na6 O52 | P -1 | 14.4465; 15.4789; 19.1776 78.228; 69.194; 84.717 | 3923.5 | Kinkini Roy; Chun Wang; Mark D. Smith; Perry J. Pellechia; Linda S. Shimizu Alkali Metal Ions As Probes of Structure and Recognition Properties of Macrocyclic Pyridyl Urea Hosts Journal of Organic Chemistry, 2010, 75, 5453-5460 |
4021288 | CIF | C117 H42 N6 Zn | P 1 21/n 1 | 17.7939; 20.8707; 20.5047 90; 90.178; 90 | 7614.8 | Fatma T. Tat; Zhiguo Zhou; Shaun MacMahon; Fayi Song; Arnold L. Rheingold; Luis Echegoyen; David I. Schuster; Stephen R. Wilson A New Fullerene Complexation Ligand: N-Pyridylfulleropyrrolidine Journal of Organic Chemistry, 2004, 69, 4602-4606 |
4031490 | CIF | C117.72 H89.72 Cl17.16 N18 Zn2 | P -1 | 14.171; 14.945; 17.378 93.35; 111.87; 115.3 | 2982.2 | Ding, Huimin; Wu, Xiaojun; Zeller, Matthias; Xie, Yunpeng; Wang, Cheng Controllable Synthesis of Covalent Porphyrinic Cages with Varying Sizes via Template-Directed Imine Condensation Reactions. The Journal of organic chemistry, 2015, 80, 9360-9364 |
4023635 | CIF | C117.75 H118.3 N10 O16 | P -1 | 15.4134; 18.2684; 22.2011 91.567; 107.567; 114.495 | 5339 | Byron W. Purse; Sara M. Butterfield; Pablo Ballester; Alexander Shivanyuk; Julius Rebek, Jr. Interaction Energies and Dynamics of Acid-Base Pairs Isolated in Cavitands Journal of Organic Chemistry, 2008, 73, 6480-6488 |
4023211 | CIF | C118 H110 Cl4 N10 Ni2 O3 | P 1 21/c 1 | 17.642; 16.1; 18.234 90; 90.023; 90 | 5179.1 | Romain Ruppert; Christophe Jeandon; Henry J. Callot Nonaromatic Corroles: Regioselectivity of Electrophilic Substitution Journal of Organic Chemistry, 2008, 73, 694-700 |
4032232 | CIF | C118 H114 F28 N4 O12 S4 | P -1 | 12.0743; 13.2209; 17.073 71.182; 73.445; 83.504 | 2472.1 | Mallick, Abhijit; Oh, Juwon; Majewski, Marcin A.; Stępień, Marcin; Kim, Dongho; Rath, Harapriya Protonation Dependent Topological Dichotomy of Core Modified Hexaphyrins: Synthesis, Characterization, and Excited State Dynamics. The Journal of organic chemistry, 2017, 82, 556-566 |
4021453 | CIF | C118 H118 N16 O20 | P -1 | 15.446; 18.167; 21.565 81.08; 82.77; 82.46 | 5892 | Zhi-Qiang Hu; Hai-Yu Hu; Chuan-Feng Chen Phenanthroline Dicarboxamide-Based Helical Foldamers: Stable Helical Structures in Methanol Journal of Organic Chemistry, 2006, 71, 1131-1138 |
4023634 | CIF | C118 H120 N9 O16.5 | P -1 | 15.501; 18.249; 22.303 91.827; 107.458; 114.319 | 5396.1 | Byron W. Purse; Sara M. Butterfield; Pablo Ballester; Alexander Shivanyuk; Julius Rebek, Jr. Interaction Energies and Dynamics of Acid-Base Pairs Isolated in Cavitands Journal of Organic Chemistry, 2008, 73, 6480-6488 |
4033392 | CIF | C118 H156 N22 O23 S6 | P -1 | 11.713; 12.688; 21.381 100.163; 92.151; 96.439 | 3102.6 | Zhao, Meng-Yao; Wang, De-Xian; Wang, Mei-Xiang Synthesis, Structure, and Properties of Corona[6]arenes and Their Assembly with Anions in the Crystalline State. The Journal of organic chemistry, 2018, 83, 1502-1509 |
4026248 | CIF | C118 H99 N10 O6 Zn2 | P 1 21/c 1 | 12.803; 23.382; 33.72 90; 94.558; 90 | 10062 | Laura P. Hernández-Eguía; Eduardo C. Escudero-Adán; Julio R. Pinzón; Luis Echegoyen; Pablo Ballester Complexation of Sc3N@C80 Endohedral Fullerene with Cyclic Zn-Bisporphyrins: Solid State and Solution Studies Journal of Organic Chemistry, 2011, 76, 3258-3265 |
4038134 | CIF | C118 H99 N9 | I -4 | 28.056; 28.056; 5.2757 90; 90; 90 | 4152.71 | Górski, Krzysztof; Mech-Piskorz, Justyna; Leśniewska, Barbara; Pietraszkiewicz, Oksana; Pietraszkiewicz, Marek Toward Soluble 5,10-Diheterotruxenes: Synthesis and Reactivity of 5,10-Dioxatruxenes, 5,10-Dithiatruxenes, and 5,10-Diazatruxenes. The Journal of organic chemistry, 2020, 85, 4672-4681 |
4025003 | CIF | C119 H109 Cl3 N2 O8 | C 1 2/c 1 | 20.637; 21.858; 22.694 90; 108.444; 90 | 9711 | Jarugu Narasimha Moorthy; Palani Natarajan; Paloth Venugopalan Abundant Lattice Inclusion Phenomenon with Sterically Hindered and Inherently Shape-Selective Tetraarylpyrenes Journal of Organic Chemistry, 2009, 74, 8566-8577 |
4032966 | CIF | C119 H158 Cl9 O10 | P -1 | 14.89; 18.123; 21.671 81.371; 82.134; 87.707 | 5726 | Al-Azemi, Talal F; Vinodh, Mickey; Alipour, Fatemeh H.; Mohamod, Abdirahman A. Constitutional Isomers of Pentahydroxy-Functionalized Pillar[5]arenes: Synthesis, Characterization, and Crystal Structures. The Journal of organic chemistry, 2017, 82, 10945-10952 |
4035909 | CIF | C119 H59 Cl15 F40 N12 O8 Os2 | P -1 | 13.33; 16.128; 16.174 115.91; 90.019; 92.124 | 3125 | Hewage, Nisansala; Daddario, Pedro; Lau, Kimberly S. F.; Guberman-Pfeffer, Matthew J; Gascón, José A; Zeller, Matthias; Lee, Christal O.; Khalil, Gamal E.; Gouterman, Martin; Brückner, Christian Bacterio- and Isobacteriodilactones by Stepwise or Direct Oxidations of meso-Tetrakis(pentafluorophenyl)porphyrin. The Journal of organic chemistry, 2019, 84, 239-256 |
4034180 | CIF | C119.75 H153.5 N24 O25 | P -1 | 14.357; 15.749; 30.441 84.29; 77.01; 63.61 | 6008 | Oshchepkov, Aleksandr S.; Shumilova, Tatiana A.; Zerson, Mario; Magerle, Robert; Khrustalev, Victor N.; Kataev, Evgeny A. Conformational Selection in Anion Recognition: cGMP-Selective Binding by a Naphthalimide-Functionalized Amido-Amine Macrocycle. The Journal of organic chemistry, 2019, 84, 9034-9043 |
4020278 | CIF | C12 H10 Ag F3 O2 Se5 | P 1 21/a 1 | 18.561; 10.596; 9.523 90; 90.92; 90 | 1872 | Toshio Shimizu; Mari Kawaguchi; Takahiro Tsuchiya; Kazunori Hirabayashi; Nobumasa Kamigata Journal of Organic Chemistry, 2005, 70, 5036-5044 |
4038603 | CIF | C12 H10 B N3 O5 | P 1 21 1 | 3.7451; 7.501; 21.773 90; 92.94; 90 | 610.8 | Suzuki, Yota; Ikeda, Ayumi; Ohno, Keiji; Fujihara, Takashi; Sugaya, Tomoaki; Ishihara, Koji <i>o</i>-Azophenylboronic Acid-Based Colorimetric Sensors for d-Fructose: <i>o</i>-Azophenylboronic Acids with Inserted Protic Solvent Are the Key Species for a Large Color Change. The Journal of organic chemistry, 2020 |
4020222 | CIF | C12 H10 Br F O3 | P 21 21 21 | 3.9446; 15.7446; 18.1173 90; 90; 90 | 1125.2 | Gillian E. Morton; Anthony G. M. Barrett Journal of Organic Chemistry, 2005, 70, 3525-3529 |
4029185 | CIF | C12 H10 Br N O | P -1 | 8.3861; 8.3872; 9.008 95.574; 100.912; 112.227 | 565.89 | Lin, Mei-Huey; Huang, Yen-Chih; Kuo, Chung-Kai; Tsai, Chang-Hsien; Li, Yi-Syuan; Hu, Ting-Chia; Chuang, Tsung-Hsun γ-Halo-enones: A Method for their Synthesis from Arylacyl Halides and Their Application to the Preparation of Five-Membered Ring Heterocycles. The Journal of organic chemistry, 2014, 79, 2751-2757 |
4031339 | CIF | C12 H10 Br N O | P 21 21 21 | 5.839; 7.548; 24.921 90; 90; 90 | 1098.3 | Zhang, Lijun; Tu, Bing; Ge, Min; Li, Yimei; Chen, Liangyu; Wang, Wei; Zhou, Shuangliu Asymmetric Addition of Pyridyl Aluminum Reagents to Aldehydes Catalyzed by a Titanium(IV) Catalytic System of (R)-H8-BINOLate. The Journal of organic chemistry, 2015, 80, 8307-8313 |
4038466 | CIF | C12 H10 Br N O2 | P 1 21/c 1 | 9.601; 9.516; 12.832 90; 92.868; 90 | 1170.9 | Gao, Peng; Chen, Huai-Juan; Bai, Zi-Jing; Zhao, Mi-Na; Yang, Desuo; Wang, Juan; Wang, Ning; Du, Lele; Guan, Zheng-Hui IBX-Promoted Oxidative Cyclization of N-Hydroxyalkyl Enamines: A Metal-free Approach towards 2,3-Disubstituted Pyrroles and Pyridines. The Journal of organic chemistry, 2020 |
4025138 | CIF | C12 H10 Br N O2 S | P b c m | 13.0465; 13.8969; 6.7162 90; 90; 90 | 1217.69 | Baolu Shi; Alexander J. Blake; William Lewis; Ian B. Campbell; Brian D. Judkins; Christopher J. Moody Rhodium Carbene Routes to Oxazoles and Thiazoles. Catalyst Effects in the Synthesis of Oxazole and Thiazole Carboxylates, Phosphonates, and Sulfones Journal of Organic Chemistry, 2010, 75, 152-161 |
4035420 | CIF | C12 H10 Br N O3 | P 1 21/c 1 | 15.355; 6.4821; 13.0958 90; 114.676; 90 | 1184.4 | Shen, Yue; Chai, Jun; Yang, Gaosheng; Chen, Wenlong; Chai, Zhuo Stereocontrolled Synthesis of trans/ cis-2,3-Disubstituted Cyclopropane-1,1-diesters and Applications in the Syntheses of Furanolignans. The Journal of organic chemistry, 2018, 83, 12549-12558 |
4026350 | CIF | C12 H10 Cl F4 N O3 S | C 1 2 1 | 25.2; 5.6924; 11.547 90; 106.213; 90 | 1590.5 | Li-Juan Liu; Ling-Jun Chen; Peng Li; Xiao-Bo Li; Jin-Tao Liu Optically Pure Polyfluoroalkanesulfinamides: Synthesis and Application as Promising and Monitorable Chiral Auxiliaries Journal of Organic Chemistry, 2011, 76, 4675-4681 |
4025136 | CIF | C12 H10 Cl N O3 | P 1 21/n 1 | 8.0491; 11.8783; 11.8348 90; 91.541; 90 | 1131.11 | Baolu Shi; Alexander J. Blake; William Lewis; Ian B. Campbell; Brian D. Judkins; Christopher J. Moody Rhodium Carbene Routes to Oxazoles and Thiazoles. Catalyst Effects in the Synthesis of Oxazole and Thiazole Carboxylates, Phosphonates, and Sulfones Journal of Organic Chemistry, 2010, 75, 152-161 |
4032889 | CIF | C12 H10 Cl N S2 | P 21 21 21 | 7.40246; 7.5881; 21.4216 90; 90; 90 | 1203.26 | Belot, Vincent; Farran, Daniel; Jean, Marion; Albalat, Muriel; Vanthuyne, Nicolas; Roussel, Christian Steric Scale of Common Substituents from Rotational Barriers of N-(o-Substituted aryl)thiazoline-2-thione Atropisomers. The Journal of organic chemistry, 2017, 82, 10188-10200 |
4028370 | CIF | C12 H10 Cl2 O2 | C 1 2/c 1 | 19.9063; 6.7658; 17.8716 90; 101.317; 90 | 2360.18 | Wei Wang; Wen-Jie Zhang; Lei Wang; Ching Kheng Quah; Hoong-Kun Fun; Jian-Hua Xu; Yan Zhang Photoinduced Reactions of para-Quinones with Bicyclopropylidene Leading to Diverse Polycyclic Compounds with Spirocyclopropanes Journal of Organic Chemistry, 2013, 78, 6211-6222 |
4038927 | CIF | C12 H10 Cl2 O3 | P 1 21/c 1 | 10.818; 10.444; 10.9 90; 105.617; 90 | 1186.1 | Norseeda, Krissada; Chaisan, Nattawadee; Thongsornkleeb, Charnsak; Tummatorn, Jumreang; Ruchirawat, Somsak Correction to "Metal-Free Synthesis of 4-Chloroisocoumarins by TMSCl-Catalyzed NCS-Induced Chlorinative Annulation of 2-Alkynylaryloate Esters". The Journal of organic chemistry, 2020 |
4021634 | CIF | C12 H10 Cr O4 | C 1 2/c 1 | 28.769; 7.5895; 21.58 90; 101.375; 90 | 4619.4 | Hechun Lin; Qian Chen; Lidong Cao; Li Yang; Yun-Dong Wu; Chaozhong Li Effect of M(CO)~3~ (M = Cr, Mn^+^) on Aromatic C-Cl BDE in (η-ArCl)M(CO)~3~ Complexes Journal of Organic Chemistry, 2006, 71, 3328-3331 |
4023920 | CIF | C12 H10 F2 N2 | P -1 | 7.337; 10.6664; 13.1655 92.05; 95.711; 94.074 | 1021.67 | Yun Ma; Sean Breslin; Ivan Keresztes; Emil Lobkovsky; David B. Collum Synthesis of a 7-Azaindole by Chichibabin Cyclization: Reversible Base-Mediated Dimerization of 3-Picolines Journal of Organic Chemistry, 2008, 73, 9610-9618 |
4035596 | CIF | C12 H10 F3 N O2 S | P 1 21/n 1 | 12.5508; 4.7813; 20.425 90; 103.082; 90 | 1193.9 | Wang, Rongkang; Jiang, Lvqi; Yi, Wenbin Metal-Free Electrophilic Trifluoroethylthiolation with NaSO<sub>2</sub>CH<sub>2</sub>CF<sub>3</sub>. The Journal of organic chemistry, 2018, 83, 7789-7798 |
4023449 | CIF | C12 H10 F3 N O5 S | R 3 c :H | 31.351; 31.351; 7.6711 90; 90; 120 | 6529.8 | Zhenglai Fang; Yunlong Song; Taradas Sarkar; Ernest Hamel; William E. Fogler; Gregory E. Agoston; Phillip E. Fanwick; Mark Cushman Stereoselective Synthesis of 3,3-Diarylacrylonitriles as Tubulin Polymerization Inhibitors Journal of Organic Chemistry, 2008, 73, 4241-4244 |
4023784 | CIF | C12 H10 F3 N3 O | P -1 | 6.828; 8.565; 11.405 111.446; 90.298; 103.166 | 601.6 | Ronald Grigg; Visuvanathar Sridharan; Mufakhrul Shah; Simon Mutton; Colin Kilner; David MacPherson; Peter Milner Regioselective Synthesis of N-Aminoisoindolones and Mono-N- and Di-N,N'-substituted Phthalazones Utilizing Hydrazine Nucleophiles in a Palladium-Catalyzed Three-Component Cascade Process Journal of Organic Chemistry, 2008, 73, 8352-8356 |
4024063 | CIF | C12 H10 F4 N2 O | P 1 21/c 1 | 5.1074; 17.39; 12.98 90; 100.79; 90 | 1132.5 | Hiroyuki Suzuki; Norio Sakai; Ryohei Iwahara; Takayuki Fujiwaka; Mitsunobu Satoh; Akikazu Kakehi; Takeo Konakahara Novel Synthesis of 7-Fluoro-8-(trifluoromethyl)-1H-1,6-naphthyridin-4-one Derivatives: Intermolecular Cyclization of an N-Silyl-1-azaallyl Anion with Perfluoroalkene and Subsequent Intramolecular Skeletal Transformation of the Resulting Pentasubstituted Pyridines Journal of Organic Chemistry, 2007, 72, 5878-5881 |
4027553 | CIF | C12 H10 F5 N O4 | P c a 21 | 11.3522; 12.9233; 9.3901 90; 90; 90 | 1377.6 | Masruri; Anthony C. Willis; Malcolm D. McLeod Osmium-Catalyzed Vicinal Oxyamination of Alkenes by N-(4-Toluenesulfonyloxy)carbamates Journal of Organic Chemistry, 2012, 77, 8480-8491 |
4023791 | CIF | C12 H10 F6 N3 P | P 1 21/c 1 | 5.9208; 30.045; 7.824 90; 108.27; 90 | 1321.6 | Yajun Ma; Siping Wei; Jingbo Lan; Jingzhi Wang; Rugang Xie; Jingsong You Pyrido[1,2-a][1,2,4]triazol-3-ylidenes as a New Family of Stable Annulated N-Heterocyclic Carbenes: Synthesis, Reactivity, and Their Application in Coordination Chemistry and Organocatalysis Journal of Organic Chemistry, 2008, 73, 8256-8264 |
4029041 | CIF | C12 H10 N2 O | P 1 21/c 1 | 7.8684; 13.971; 8.8557 90; 99.47; 90 | 960.2 | Lv, Jinglei; Zhang-Negrerie, Daisy; Deng, Jun; Du, Yunfei; Zhao, Kang Metal-Free Synthesis of 2-Oxindoles via PhI(OAc)2-Mediated Oxidative C-C Bond Formation. The Journal of organic chemistry, 2014, 79, 1111 |
4032835 | CIF | C12 H10 N2 O2 S2 | P c a 21 | 10.81; 14.1314; 8.1358 90; 90; 90 | 1242.83 | Patra, Sumit Kumar; Sheet, Sanjoy Kumar; Sen, Bhaskar; Aguan, Kripamoy; Roy, Debesh Ranjan; Khatua, Snehadrinarayan Highly Sensitive Bifunctional Probe for Colorimetric Cyanide and Fluorometric H2S Detection and Bioimaging: Spontaneous Resolution, Aggregation, and Multicolor Fluorescence of Bisulfide Adduct. The Journal of organic chemistry, 2017, 82, 10234-10246 |
4020016 | CIF | C12 H10 N2 O6 | P 1 21/n 1 | 12.511; 5.682; 18.53 90; 102.443; 90 | 1286 | Francesca Aulenta; Michael G.B. Drew; Alison Foster; Wayne Hayes; Steven Rannard; David W. Thornthwaite; David R. Worrall; Tristan G.A. Youngs Journal of Organic Chemistry, 2005, 70, 63-78 |
4027243 | CIF | C12 H10 N2 O6 | P 1 21/c 1 | 6.8882; 20.8439; 8.2554 90; 90.028; 90 | 1185.29 | Xinfang Xu; Dmitry Shabashov; Peter Y. Zavalij; Michael P. Doyle Substrate-Dependent Divergent Outcomes from Catalytic Reactions of Silyl-Protected Enol Diazoacetates with Nitrile Oxides: Azabicyclo[3.1.0]hexanes or 5-Arylaminofuran-2(3H)-ones Journal of Organic Chemistry, 2012, 77, 5313-5317 |
4021704 | CIF | C12 H10 N8 | P 1 21/c 1 | 28.454; 12.209; 7.1539 90; 95.85; 90 | 2472.3 | Minghong Zhong; Ireneusz Nowak; John F. Cannon; Morris J. Robins Structure and Synthesis of 6-(Substituted-imidazol-1-yl)purines: Versatile Substrates for Regiospecific Alkylation and Glycosylation at N9 Journal of Organic Chemistry, 2006, 71, 4216-4221 |
4020972 | CIF | C12 H10 O S | P b c a | 20.78; 11.496; 8.242 89; 89; 90 | 1968 | Yuichi Sawada; Akira Oku Carbon-Carbon Bond-Forming Reaction of Cyclic Sulfonium Ylides Stabilized by a Carbonyl Group Journal of Organic Chemistry, 2004, 69, 2899-2901 |
4036503 | CIF | C12 H10 O2 | P 1 21/n 1 | 12.5612; 7.0515; 15.0777 90; 109.371; 90 | 1259.91 | Cindro, Nikola; Antol, Ivana; Mlinarić-Majerski, Kata; Halasz, Ivan; Wan, Peter; Basarić, Nikola Reactivity of Cations and Zwitterions Formed in Photochemical and Acid-Catalyzed Reactions from m-Hydroxycycloalkyl-Substituted Phenol Derivatives. The Journal of organic chemistry, 2015, 80, 12420-12430 |
4023580 | CIF | C12 H10 O2 S | P 1 21/c 1 | 9.9439; 6.1791; 17.0548 90; 100.571; 90 | 1030.14 | Victorio Cadierno; Josefina Díez; José Gimeno; Noel Nebra Ruthenium/TFA-Catalyzed Coupling of Activated Secondary Propargylic Alcohols with Cyclic 1,3-Diones: Furan versus Pyran Ring Formation Journal of Organic Chemistry, 2008, 73, 5852-5858 |
4028254 | CIF | C12 H10 O2 S | P 1 21/n 1 | 8.4875; 6.6947; 17.625 90; 92.5; 90 | 1000.5 | Peng Zhao; Hang Yin; Hongxin Gao; Chanjuan Xi Cu-Catalyzed Synthesis of Diaryl Thioethers and S-Cycles by Reaction of Aryl Iodides with Carbon Disulfide in the Presence of DBU Journal of Organic Chemistry, 2013, 78, 5001-5006 |
4035926 | CIF | C12 H10 O2 S2 | P 1 21/n 1 | 7.9063; 8.9584; 7.9434 90; 99.907; 90 | 554.22 | Kolanji, Kubandiran; Postulka, Lars; Wolf, Bernd; Lang, Michael; Schollmeyer, Dieter; Baumgarten, Martin Planar Benzo[1,2- b:4,5- b']dithiophene Derivatives Decorated with Nitronyl and Imino Nitroxides. The Journal of organic chemistry, 2019, 84, 140-149 |
4038705 | CIF | C12 H10 O3 | P 1 21/n 1 | 10.1493; 6.7882; 14.1297 90; 95.25; 90 | 969.39 | Zhang, Ke; Zhang, Wen-Zhen; Tao, Xue-Yan; Zhang, Min; Ren, Wei-Min; Lu, Xiao-Bing Carboxylative Cyclization of 2-Butenoates with Carbon Dioxide: Access to Glutaconic Anhydrides. The Journal of organic chemistry, 2020 |
4030314 | CIF | C12 H10 O4 | P -1 | 7.5873; 8.0869; 10.0489 102.73; 96.588; 117.756 | 515.07 | Zhang, Mingliang; Zhang, Hui-Jun; Han, Tiantian; Ruan, Wenqing; Wen, Ting-Bin Rh(III)-Catalyzed Oxidative Coupling of Benzoic Acids with Geminal-Substituted Vinyl Acetates: Synthesis of 3-Substituted Isocoumarins. The Journal of organic chemistry, 2014, 80, 620 |
4033937 | CIF | C12 H10 O4 | P 1 21/c 1 | 5.4376; 9.2746; 19.1403 90; 97.111; 90 | 957.85 | Gholap, Sachin P.; Jangid, Dashrath; Fernandes, Rodney A. Metal-Free Brønsted Acid-Catalyzed Rearrangement of δ-Hydroxyalkynones to 2,3-Dihydro-4 H-pyran-4-ones: Total Synthesis of Obolactone and a Catechol Pyran Isolated from Plectranthus sylvestris. The Journal of organic chemistry, 2019, 84, 3537-3551 |
4036029 | CIF | C12 H10 O4 | P 1 21/c 1 | 11.7219; 11.6068; 7.8791 90; 108.63; 90 | 1015.81 | Grandane, Aiga; Longwitz, Lars; Roolf, Catrin; Spannenberg, Anke; Murua Escobar, Hugo; Junghanss, Christian; Suna, Edgars; Werner, Thomas Intramolecular Base-Free Catalytic Wittig Reaction: Synthesis of Benzoxepinones. The Journal of organic chemistry, 2019, 84, 1320-1329 |
4038703 | CIF | C12 H10 O4 | P 1 21/n 1 | 10.5027; 7.0136; 13.6611 90; 96.983; 90 | 998.84 | Zhang, Ke; Zhang, Wen-Zhen; Tao, Xue-Yan; Zhang, Min; Ren, Wei-Min; Lu, Xiao-Bing Carboxylative Cyclization of 2-Butenoates with Carbon Dioxide: Access to Glutaconic Anhydrides. The Journal of organic chemistry, 2020 |
4038285 | CIF | C12 H11 B F2 I N3 O S | P 1 21/c 1 | 15.7049; 12.0661; 7.702 90; 94.888; 90 | 1454.2 | Potopnyk, Mykhaylo A.; Volyniuk, Dmytro; Luboradzki, Roman; Ceborska, Magdalena; Hladka, Iryna; Danyliv, Yan; Grazulevicius, Juozas V. Organolithium-Mediated Postfunctionalization of Thiazolo[3,2-<i>c</i>][1,3,5,2]oxadiazaborinine Fluorescent Dyes. The Journal of organic chemistry, 2020, 85, 6060-6072 |
4021559 | CIF | C12 H11 B F2 N2 O2 | P 1 21/n 1 | 7.2512; 10.18; 15.873 90; 91.287; 90 | 1171.4 | Chikoto Fujimoto; Yukio Kusunose; Hiromitsu Maeda CH···Anion Interaction in BF~2~ Complexes of C~3~-Bridged Oligopyrroles Journal of Organic Chemistry, 2006, 71, 2389-2394 |
4021358 | CIF | C12 H11 Br N2 O S2 | P 1 21/n 1 | 16.084; 4.545; 19.622 90; 97.97; 90 | 1420.6 | Akiyuki Hamasaki; Richard Ducray; Dale L. Boger Two Novel 1,2,4,5-Tetrazines that Participate in Inverse Electron Demand Diels-Alder Reactions with an Unexpected Regioselectivity Journal of Organic Chemistry, 2006, 71, 185-193 |
4026635 | CIF | C12 H11 Br N2 O2 | P 1 21/c 1 | 6.6242; 21.6424; 8.2186 90; 104.05; 90 | 1143 | Wei-Ti Chuang; Cheng-Chih Hsieh; Chin-Hung Lai; Cheng-Hsuan Lai; Chun-Wei Shih; Kew-Yu Chen; Wen-Yi Hung; Yu-Hsiang Hsu; Pi-Tai Chou Excited-State Intramolecular Proton Transfer Molecules Bearing o-Hydroxy Analogues of Green Fluorescent Protein Chromophore Journal of Organic Chemistry, 2011, 76, 8189-8202 |
4020637 | CIF | C12 H11 Br O2 | P 1 21 1 | 5.589; 9.069; 11.255 90; 92.84; 90 | 569.8 | Weiqing Yang; Deju Shang; Yanling Liu; Ying Du; Xiaoming Feng Highly Enantioselective Synthesis of 2,6-Disubstituted and 2,2,6-Trisubstituted Dihydropyrones: A One-Step Synthesis of (R)-(+)-Hepialone and Its Analogues Journal of Organic Chemistry, 2005, 70, 8533-8537 |
4026520 | CIF | C12 H11 Cl N2 O S | P 21 21 21 | 4.3122; 10.505; 27.486 90; 90; 90 | 1245.1 | Tom Verhelst; Jens Maes; Zuming Liu; Sergey Sergeyev; Bert U. W. Maes Synthesis of Functionalized Pyridazin-3(2H)-ones via Selective Bromine-Magnesium Exchange and Lactam Directed Ortho C-H Magnesiation Journal of Organic Chemistry, 2011, 76, 6670-6677 |
4020221 | CIF | C12 H11 F O3 | P 1 21/n 1 | 16.5; 3.962; 17.251 90; 113.076; 90 | 1037.5 | Gillian E. Morton; Anthony G. M. Barrett Journal of Organic Chemistry, 2005, 70, 3525-3529 |
4024521 | CIF | C12 H11 F2 N O2 | P b c a | 10.2395; 8.8488; 25.3299 90; 90; 90 | 2295.07 | Teerawut Bootwicha; Duanghathai Panichakul; Chutima Kuhakarn; Samran Prabpai; Palangpon Kongsaeree; Patoomratana Tuchinda; Vichai Reutrakul; Manat Pohmakotr Fluoride-Catalyzed Addition of PhSCF2SiMe3 to N-Substituted Cyclic Imides Followed by Radical Cyclization: General Synthetic Strategy of gem-Difluoromethylenated 1-Azabicyclic Compounds Journal of Organic Chemistry, 2009, 74, 3798-3805 |
4033321 | CIF | C12 H11 F3 N2 O | P 1 21/c 1 | 8.853; 19.2845; 8.0635 90; 116.194; 90 | 1235.3 | Wang, Yuxiang; Wang, Ke-Hu; Su, Yingpeng; Yang, Zheng; Wen, Lan; Liu, Lili; Wang, Juanjuan; Huang, Danfeng; Hu, Yulai Cascade Oxidation/Halogenoaminocyclization Reaction of Trifluoromethylated Homoallylic N-Acylhydrazines: Metal-free Synthesis of CF<sub>3</sub>-Substituted Pyrazolines. The Journal of organic chemistry, 2018, 83, 939-950 |
4033817 | CIF | C12 H11 F3 N2 O | P b c n | 15.6241; 17.7725; 8.396 90; 90; 90 | 2331.4 | Rocha, Mariana; Gil, Diego M.; Echeverría, Gustavo A; Piro, Oscar E.; Jios, Jorge L.; Ulic, Sonia E. Enol-imino-Keto-enamine Tautomerism in a Diazepine Derivative: How Decisive Are the Intermolecular Interactions in the Equilibrium? The Journal of organic chemistry, 2019, 84, 11042-11053 |
4037292 | CIF | C12 H11 F3 N2 O4 | P b c a | 11.93; 9.6569; 22.248 90; 90; 90 | 2563.1 | Rulev, Alexander Yu; Romanov, Alexey R.; Kondrashov, Evgeniy V.; Ushakov, Igor A.; Vashchenko, Alexander V.; Muzalevskiy, Vasiliy M.; Nenajdenko, Valentine G. Domino Assembly of Trifluoromethylated N,O-Heterocycles by the Reaction of Fluorinated α-Bromoenones with Amino Alcohols. The Journal of organic chemistry, 2016, 81, 10029-10034 |
4024191 | CIF | C12 H11 F5 N O6 P | P -1 | 6.1721; 8.3012; 17.1703 100.228; 96.551; 104.693 | 825.66 | Jinhua Song; Hiroshi Yamataka; Zvi Rappoport Dialkoxyphosphinyl-Substituted Enols of Carboxamides Journal of Organic Chemistry, 2007, 72, 7605-7624 |
4020003 | CIF | C12 H11 I N2 O2 | P 1 21/c 1 | 10.361; 7.742; 15.539 90; 107.664; 90 | 1187.69 | Blakemore, Paul R.; Kilner, Colin; Milicevic, Selena D. Harnessing Anionic Rearrangements on the Benzenoid Ring of Quinoline for the Synthesis of 6,6'-Disubstituted 7,7'-Dihydroxy-8,8'-biquinolyls The Journal of Organic Chemistry, 2005, 70, 373-376 |
4024644 | CIF | C12 H11 N | P 1 21/n 1 | 11.907; 5.6848; 12.95 90; 92.517; 90 | 875.7 | Feldman, Ken S.; Hester, D. Keith; Iyer, Malliga R.; Munson, Paul J.; Silva López, Carlos; Faza, Olalla Nieto Allenyl Azide Cycloaddition Chemistry. 2,3-Cyclopentennelated Indole Synthesis through Indolidene Intermediates Journal of Organic Chemistry, 2009, 74, 4958-4974 |
4022054 | CIF | C12 H11 N O | C 1 2/c 1 | 13.4126; 12.6904; 13.4632 90; 113.86; 90 | 2095.7 | Kara West; Changsheng Wang; Andrei S. Batsanov; Martin R. Bryce Are Terminal Aryl Butadiynes Stable? Synthesis and X-ray Crystal Structures of a Series of Aryl- and Heteroaryl-butadiynes (Ar-C\τbC-C\τbC-H) Journal of Organic Chemistry, 2006, 71, 8541-8544 |
4034453 | CIF | C12 H11 N O | P 1 21/n 1 | 7.0898; 9.8867; 14.0714 90; 99.057; 90 | 974.03 | Ghosh, Sanjib; Roy, Biswajit; Bandyopadhyay, Subhajit Formation or Cleavage of Rings via Sulfide-Mediated Reduction Offers Background-Free Detection of Sulfide. The Journal of organic chemistry, 2019, 84, 12031-12039 |
4022606 | CIF | C12 H11 N O2 | P -1 | 3.999; 11.1539; 12.225 71.924; 89.51; 81.01 | 511.55 | Lasri, Jamal; Charmier, M. Adília Januário; Haukka, Matti; Pombeiro, Armando J. L. Stereospecific Synthesis of Polysubstituted E-Olefins by Reaction of Acyclic Nitrones with Free and Platinum(II) Coordinated Organonitriles Journal of Organic Chemistry, 2007, 72, 750-755 |
4024362 | CIF | C12 H11 N O2 | P b c a | 8.7421; 17.848; 12.4786 90; 90; 90 | 1947.02 | Leo A. Paquette; Robert D. Dura; Isabelle Modolo Contrasting Responses of Pyrido[2,1-a]isoindol-6-ones and Their Sultam Counterparts to Photochemical Activation Journal of Organic Chemistry, 2009, 74, 1982-1987 |
4025792 | CIF | C12 H11 N O2 | P 1 21/c 1 | 9.867; 8.666; 11.827 90; 94.43; 90 | 1008.3 | Noriko Okamoto; Kei Takeda; Reiko Yanada Platinum-Catalyzed, One-Pot Tandem Synthesis of Indoles and Isoquinolines via Sequential Rearrangement of Amides and Aminocyclization Journal of Organic Chemistry, 2010, 75, 7615-7625 |
4035262 | CIF | C12 H11 N O2 | P 1 21/c 1 | 8.6966; 12.4116; 21.1857 90; 96.602; 90 | 2271.59 | Qiu, Yun; Dlugosch, Michael; Liu, Xin; Khan, Faiyaz; Ward, Jas S.; Lan, Ping; Banwell, Martin G. Reductive Cyclization of o-Nitroarylated-α,β-unsaturated Aldehydes and Ketones with TiCl<sub>3</sub>/HCl or Fe/HCl Leading to 1,2,3,9-Tetrahydro-4 H-carbazol-4-ones and Related Heterocycles. The Journal of organic chemistry, 2018, 83, 12023-12033 |
4038417 | CIF | C12 H11 N O2 | P 1 21/n 1 | 7.0408; 9.2884; 16.116 90; 96.743; 90 | 1046.7 | Kielmann, Marc; Flanagan, Keith J.; Senge, Mathias O. Targeted Synthesis of Regioisomerically Pure Dodecasubstituted Type I Porphyrins through the Exploitation of Peri-interactions. The Journal of organic chemistry, 2020 |
4038467 | CIF | C12 H11 N O2 | P 1 21/n 1 | 12.858; 9.1867; 18.757 90; 104.697; 90 | 2143.1 | Gao, Peng; Chen, Huai-Juan; Bai, Zi-Jing; Zhao, Mi-Na; Yang, Desuo; Wang, Juan; Wang, Ning; Du, Lele; Guan, Zheng-Hui IBX-Promoted Oxidative Cyclization of N-Hydroxyalkyl Enamines: A Metal-free Approach towards 2,3-Disubstituted Pyrroles and Pyridines. The Journal of organic chemistry, 2020 |
4022042 | CIF | C12 H11 N O2 S | C 1 c 1 | 11.46; 11.07; 17.536 90; 100.395; 90 | 2188.1 | Leo A. Paquette; Robert D. Dura; Nathan Fosnaugh; Marshall Stepanian Direct Comparison of the Response of Bicyclic Sultam and Lactam Dienes to Photoexcitation. Concerning the Propensity of Differing Bond Types to Bridgehead Nitrogen for Homolytic Cleavage Journal of Organic Chemistry, 2006, 71, 8438-8445 |
4027739 | CIF | C12 H11 N O3 | P b c a | 13.207; 8.4523; 18.886 90; 90; 90 | 2108.2 | Yunhui Zheng; Xuming Li; Chengfeng Ren; Daisy Zhang-Negrerie; Yunfei Du; Kang Zhao Synthesis of Oxazoles from Enamides via Phenyliodine Diacetate-Mediated Intramolecular Oxidative Cyclization Journal of Organic Chemistry, 2012, 77, 10353-10361 |
4032056 | CIF | C12 H11 N O3 | P c a 21 | 15.8194; 7.2095; 38.1891 90; 90; 90 | 4355.47 | Xuan, Zi; Jung, Da Jung; Jeon, Hyun Ji; Lee, Sang-Gi Pd-Catalyzed Aminocarbonylation of the Blaise Reaction Intermediate: One-Pot Synthesis of (Z)-3-Methyleneisoindolin-1-ones from Nitriles. The Journal of organic chemistry, 2016, 81, 10094 |
4034455 | CIF | C12 H11 N O3 | P 1 21/c 1 | 8.8591; 12.2957; 9.3813 90; 104.579; 90 | 988.99 | Ghosh, Sanjib; Roy, Biswajit; Bandyopadhyay, Subhajit Formation or Cleavage of Rings via Sulfide-Mediated Reduction Offers Background-Free Detection of Sulfide. The Journal of organic chemistry, 2019, 84, 12031-12039 |
4036102 | CIF | C12 H11 N O3 | P c a 21 | 15.812; 7.204; 38.241 90; 90; 90 | 4356 | Chen, Xin; Ge, Fei-Fei; Lu, Tao; Zhou, Qing-Fa Stereoselective synthesis of 3-methyleneisoindolin-1-ones via base-catalyzed intermolecular reactions of electron-deficient alkynes with N-hydroxyphthalimides. The Journal of organic chemistry, 2015, 80, 3295-3301 |
4036103 | CIF | C12 H11 N O3 | P 1 21/c 1 | 13.625; 5.326; 15.273 90; 106.71; 90 | 1061.5 | Chen, Xin; Ge, Fei-Fei; Lu, Tao; Zhou, Qing-Fa Stereoselective synthesis of 3-methyleneisoindolin-1-ones via base-catalyzed intermolecular reactions of electron-deficient alkynes with N-hydroxyphthalimides. The Journal of organic chemistry, 2015, 80, 3295-3301 |
4036311 | CIF | C12 H11 N O3 | P 1 21/c 1 | 5.8418; 8.6844; 20.7247 90; 91.658; 90 | 1050.98 | Chaiyaveij, Duangduan; Batsanov, Andrei S.; Fox, Mark A.; Marder, Todd B.; Whiting, Andrew An Experimental and Computational Approach to Understanding the Reactions of Acyl Nitroso Compounds in [4 + 2] Cycloadditions. The Journal of organic chemistry, 2015, 80, 9518-9534 |
4028689 | CIF | C12 H11 N O4 S | P -1 | 8.7295; 9.9483; 13.9369 96.205; 104.131; 100.355 | 1139.85 | Kimberly Geoghegan; Shaun Smullen; Paul Evans Halonium Ion Triggered Rearrangement of Unsaturated Benzo-Annulated Bi- and Tricyclic Sulfonamides Journal of Organic Chemistry, 2013, 78, 10443-10451 |
4024841 | CIF | C12 H11 N O4 S3 | P n m a | 12.769; 7.2172; 15.297 90; 90; 90 | 1409.7 | Neta Shefer; Tal Harel; Shlomo Rozen Synthesis of Oxygenated Fused Oligothiophenes with HOF.CH3CN Journal of Organic Chemistry, 2009, 74, 6993-6998 |
4026069 | CIF | C12 H11 N O7 | P -1 | 7.746; 8.08; 11.835 86.198; 74.105; 60.673 | 619.07 | Simon Grabowsky; Tanja Schirmeister; Carsten Paulmann; Thomas Pfeuffer; Peter Luger Effect of Electron-Withdrawing Substituents on the Epoxide Ring: An Experimental and Theoretical Electron Density Analysis of a Series of Epoxide Derivatives Journal of Organic Chemistry, 2011, 76, 1305-1318 |
4037413 | CIF | C12 H11 N2 O4 P | P -1 | 7.112; 8.573; 10.427 93.082; 90.137; 91.869 | 634.5 | Chaturvedi, Atul Kumar; Kant, Ruchir; Rastogi, Namrata Access to the Phosphorylindenopyrazole Scaffold via a Metal-Free Domino Reaction of Diazoalkylphosphonates with 3-Bromophthalides. The Journal of organic chemistry, 2016, 81, 11291-11296 |
4028466 | CIF | C12 H11 N3 O | P 1 21/n 1 | 13.4019; 5.5613; 15.169 90; 111.952; 90 | 1048.61 | Borys Ośmiałowski; Karina Mroczyńska; Erkki Kolehmainen; Magdalena Kowalska; Arto Valkonen; Marek Pietrzak; Kari Rissanen Association of N-(Pyridin-2-yl),N'-substituted Ureas with 2-Amino-1,8-naphthyridines and Benzoates: NMR and Quantum Chemical Studies of the Substituent Effect on Complexation Journal of Organic Chemistry, 2013, 78, 7582-7593 |
4027276 | CIF | C12 H11 N3 O S | P 1 21/c 1 | 16.8378; 5.0024; 13.1719 90; 98.84; 90 | 1096.28 | Kalen N. Swanick; Jacquelyn T. Price; Nathan D. Jones; Zhifeng Ding Synthesis, Structure, Electrochemistry, and Electrochemiluminescence of Thienyltriazoles Journal of Organic Chemistry, 2012, 77, 5646-5655 |
4030648 | CIF | C12 H11 N3 O2 | P n a 21 | 15.7337; 7.0498; 9.911 90; 90; 90 | 1099.32 | Iaroshenko, Viktor O.; Gevorgyan, Ashot; Mkrtchyan, Satenik; Arakelyan, Knar; Grigoryan, Tatevik; Yedoyan, Julietta; Villinger, Alexander; Langer, Peter Transition-metal-catalyzed arylation of nitroimidazoles and further transformations of manipulable nitro group. The Journal of organic chemistry, 2015, 80, 2103-2119 |
4032788 | CIF | C12 H11 N3 O2 | P -1 | 6.9102; 7.5569; 21.8746 95.895; 96.939; 94.396 | 1123.32 | Huang, Adrian; Wo, Kellie; Lee, So Yeun Christine; Kneitschel, Nika; Chang, Jennifer; Zhu, Kathleen; Mello, Tatsiana; Bancroft, Laura; Norman, Natalie J.; Zheng, Shao-Liang Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles. The Journal of organic chemistry, 2017, 82, 8864-8872 |
4034352 | CIF | C12 H11 N3 O2 | C 1 2/c 1 | 18.524; 10.8785; 13.2463 90; 129.107; 90 | 2071.3 | Bollu, Amarnath; Sharma, Nagendra K. Cleavable Amide Bond: Mechanistic Insight into Cleavable 4-Aminopyrazolyloxy Acetamide at Low pH. The Journal of organic chemistry, 2019, 84, 5596-5602 |
4034452 | CIF | C12 H11 N3 O2 | P 1 21/n 1 | 8.9313; 9.6546; 13.094 90; 96.289; 90 | 1122.3 | Ghosh, Sanjib; Roy, Biswajit; Bandyopadhyay, Subhajit Formation or Cleavage of Rings via Sulfide-Mediated Reduction Offers Background-Free Detection of Sulfide. The Journal of organic chemistry, 2019, 84, 12031-12039 |
4029234 | CIF | C12 H11 N3 O3 | P 1 21/c 1 | 7.2879; 18.828; 8.5038 90; 93.045; 90 | 1165.2 | Iaroshenko, Viktor O; Gevorgyan, Ashot; Davydova, Olena; Villinger, Alexander; Langer, Peter Regioselective and guided C-h activation of 4-nitropyrazoles. The Journal of organic chemistry, 2014, 79, 2906-2915 |
4032786 | CIF | C12 H11 N3 O3 | P n a 21 | 8.9557; 26.4849; 4.792 90; 90; 90 | 1136.62 | Huang, Adrian; Wo, Kellie; Lee, So Yeun Christine; Kneitschel, Nika; Chang, Jennifer; Zhu, Kathleen; Mello, Tatsiana; Bancroft, Laura; Norman, Natalie J.; Zheng, Shao-Liang Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles. The Journal of organic chemistry, 2017, 82, 8864-8872 |
4026638 | CIF | C12 H11 N3 O4 | C 1 2/c 1 | 24.398; 3.8017; 26.608 90; 113.302; 90 | 2266.7 | Wei-Ti Chuang; Cheng-Chih Hsieh; Chin-Hung Lai; Cheng-Hsuan Lai; Chun-Wei Shih; Kew-Yu Chen; Wen-Yi Hung; Yu-Hsiang Hsu; Pi-Tai Chou Excited-State Intramolecular Proton Transfer Molecules Bearing o-Hydroxy Analogues of Green Fluorescent Protein Chromophore Journal of Organic Chemistry, 2011, 76, 8189-8202 |
4032795 | CIF | C12 H11 N3 O4 | P 1 21/n 1 | 3.79733; 11.3573; 26.8872 90; 91.2826; 90 | 1159.28 | Huang, Adrian; Wo, Kellie; Lee, So Yeun Christine; Kneitschel, Nika; Chang, Jennifer; Zhu, Kathleen; Mello, Tatsiana; Bancroft, Laura; Norman, Natalie J.; Zheng, Shao-Liang Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles. The Journal of organic chemistry, 2017, 82, 8864-8872 |
4032806 | CIF | C12 H11 N3 O4 | P 1 21/c 1 | 3.81; 26.9866; 11.1734 90; 94.412; 90 | 1145.43 | Huang, Adrian; Wo, Kellie; Lee, So Yeun Christine; Kneitschel, Nika; Chang, Jennifer; Zhu, Kathleen; Mello, Tatsiana; Bancroft, Laura; Norman, Natalie J.; Zheng, Shao-Liang Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles. The Journal of organic chemistry, 2017, 82, 8864-8872 |
4026425 | CIF | C12 H12 | P b c a | 7.3229; 6.0225; 19.985 90; 90; 90 | 881.4 | Xianlong Wang; Peter A. Beckmann; Clelia W. Mallory; Arnold L. Rheingold; Antonio G. DiPasquale; Patrick J. Carroll; Frank B. Mallory Intramolecular and Intermolecular Contributions to the Barriers for Rotation of Methyl Groups in Crystalline Solids: Electronic Structure Calculations and Solid-State NMR Relaxation Measurements Journal of Organic Chemistry, 2011, 76, 5170-5176 |
4033119 | CIF | C12 H12 B N O | P b c a | 13.9639; 9.1183; 16.431 90; 90; 90 | 2092.1 | Zhang, Ying; Sun, Feiye; Dan, Wenyan; Fang, Xiangdong Friedel-Crafts Acylation Reactions of BN-Substituted Arenes. The Journal of organic chemistry, 2017, 82, 12877-12887 |
4033111 | CIF | C12 H12 B N O2 | P c c n | 17.066; 12.178; 16.125 90; 90; 90 | 3351.3 | Zhang, Ying; Sun, Feiye; Dan, Wenyan; Fang, Xiangdong Friedel-Crafts Acylation Reactions of BN-Substituted Arenes. The Journal of organic chemistry, 2017, 82, 12877-12887 |
4021089 | CIF | C12 H12 Br I O2 | P -1 | 7.8323; 9.0392; 10.8216 105.979; 108.666; 100.361 | 666.92 | Gary A. Molander; Jason P. Burke; Patrick J. Carroll Synthesis and Application of Chiral Cyclopropane-Based Ligands in Palladium-Catalyzed Allylic Alkylation Journal of Organic Chemistry, 2004, 69, 8062-8069 |
4038429 | CIF | C12 H12 Br N O2 | P 1 21 1 | 15.5606; 8.3186; 19.5153 90; 112.799; 90 | 2328.74 | Magnus, Nicholas Andrew; Buser, Jonas Y.; Embry, Matthew C.; Kallman, Neil John Diastereoselective Pictet-Spengler Based Synthesis of a Chiral Tetrahydroisoquinoline D1 Potentiator. The Journal of organic chemistry, 2020 |
4033889 | CIF | C12 H12 Br N O2 S | P 1 21/c 1 | 13.1467; 6.1735; 15.7907 90; 94.671; 90 | 1277.33 | Wang, Pengzhi; Chau Nguyen, Khiem; Lindsey, Jonathan S. Synthesis of the Ring C Pyrrole of Native Chlorophylls and Bacteriochlorophylls. The Journal of organic chemistry, 2019, 84, 11286-11293 |
4029996 | CIF | C12 H12 Br N O5 | P 1 21 1 | 11.2767; 5.3947; 11.4249 90; 108.049; 90 | 660.83 | Roy, Suparna; Chen, Kan-Fu; Gurubrahamam, Ramani; Chen, Kwunmin Organocatalytic kinetic resolution of racemic secondary nitroallylic alcohols combined with simultaneous desymmetrization of prochiral cyclic anhydrides. The Journal of organic chemistry, 2014, 79, 8955-8959 |
4034828 | CIF | C12 H12 Br N2 O4 | P 1 21/c 1 | 7.3016; 11.2744; 16.071 90; 102.442; 90 | 1291.9 | Shangpliang, O. Risuklang; Kshiar, Baskhemlang; Wanniang, Kmendashisha; Marpna, Ibakyntiew D.; Lipon, Tyrchain Mitre; Laloo, Badaker M.; Myrboh, Bekington Selenium Dioxide As an Alternative Reagent for the Direct α-Selenoamidation of Aryl Methyl Ketones. The Journal of organic chemistry, 2018, 83, 5829-5835 |
4030654 | CIF | C12 H12 Br N3 O2 | P 21 21 21 | 7.0209; 7.6049; 23.4143 90; 90; 90 | 1250.17 | Iaroshenko, Viktor O.; Gevorgyan, Ashot; Mkrtchyan, Satenik; Arakelyan, Knar; Grigoryan, Tatevik; Yedoyan, Julietta; Villinger, Alexander; Langer, Peter Transition-metal-catalyzed arylation of nitroimidazoles and further transformations of manipulable nitro group. The Journal of organic chemistry, 2015, 80, 2103-2119 |
4026584 | CIF | C12 H12 Br2 O | P b c a | 7.532; 15.8313; 18.9055 90; 90; 90 | 2254.3 | Kuan-Jen Su; Mirjana Pačar; Jean-Luc Mieusset; Vladimir B. Arion; Udo H. Brinker Quest for Even Higher Stabilized Foiled Carbenes Journal of Organic Chemistry, 2011, 76, 7491-7496 |
4030753 | CIF | C12 H12 Br2 O | P 1 21/c 1 | 13.9526; 5.4114; 16.5276 90; 92.316; 90 | 1246.87 | Lin, Mei-Huey; Li, Yi-Syuan; Kuo, Chung-Kai; Chen, Chung-Hao; Huang, Yen-Chih; Liang, Kung-Yu; Chen, Yu-Chun; Tsai, Chang-Hsien; Chuang, Tsung-Hsun Synthesis of Hexahydro-1H-isoindole Derivatives from Arylacyl Bromides via Homoallenic Bromohydrins. The Journal of organic chemistry, 2015, 80, 2462-2466 |
4025077 | CIF | C12 H12 Br4 N2 O4 | C 1 2/c 1 | 22.162; 6.3307; 12.776 90; 113.885; 90 | 1639 | Piron, Flavia; Vanthuyne, Nicolas; Joulin, Bérangère; Naubron, Jean-Valère; Cismaş, Crina; Terec, Anamaria; Varga, Richard Attila; Roussel, Christian; Roncali, Jean; Grosu, Ion Synthesis, Structural Analysis, and Chiral Investigations of Some Atropisomers with EE-Tetrahalogeno-1,3-butadiene Core Journal of Organic Chemistry, 2009, 74, 9062-9070 |
4034968 | CIF | C12 H12 Cl N O2 | P b c a | 10.1854; 7.0105; 31.6018 90; 90; 90 | 2256.52 | Samper Barceló, Víctor; Bienz, Stefan Synthesis of Highly Substituted 3-Pyrrolin-2-ones from N,N-Disubstituted α-Amino Acids. The Journal of organic chemistry, 2018, 83, 2734-2743 |
4031559 | CIF | C12 H12 Cl N O3 | P -1 | 6.181; 7.296; 14.295 104.493; 92.4; 101.853 | 607.9 | Xing, Linlin; Li, Chunbao Stereoselective Chlorination and Bromination of Enamides and Enamines via an Electrostatic Attraction Effect Using (1,1-Diacetoxyiodo)benzene and a Halide Source. The Journal of organic chemistry, 2015, 80, 10000-10008 |
4026404 | CIF | C12 H12 Cl N O3 S | P 1 21/n 1 | 9.31754; 11.0378; 24.8795 90; 91.28; 90 | 2558.1 | Hidetsugu Tabata; Naoya Wada; Yuko Takada; Tetsuta Oshitari; Hideyo Takahashi; Hideaki Natsugari Isolation and Characterization of Atropisomers of Seven-Membered-Ring Benzolactams Journal of Organic Chemistry, 2011, 76, 5123-5131 |
4026498 | CIF | C12 H12 Cl N O5 | P 1 21 1 | 8.656; 5.919; 13.168 90; 104.521; 90 | 653.11 | Gonzalo Blay; Isabel Fernández; M. Carmen Muñoz; José R. Pedro; Alejandro Recuenco; Carlos Vila Enantioselective Synthesis of Tertiary Alcohols through a Zirconium-Catalyzed Friedel-Crafts Alkylation of Pyrroles with α-Ketoesters Journal of Organic Chemistry, 2011, 76, 6286-6294 |
4025076 | CIF | C12 H12 Cl4 N2 O4 | C 1 2/c 1 | 22.379; 5.8742; 12.425 90; 111.065; 90 | 1524.2 | Piron, Flavia; Vanthuyne, Nicolas; Joulin, Bérangère; Naubron, Jean-Valère; Cismaş, Crina; Terec, Anamaria; Varga, Richard Attila; Roussel, Christian; Roncali, Jean; Grosu, Ion Synthesis, Structural Analysis, and Chiral Investigations of Some Atropisomers with EE-Tetrahalogeno-1,3-butadiene Core Journal of Organic Chemistry, 2009, 74, 9062-9070 |
4032399 | CIF | C12 H12 F2 O3 | P -1 | 5.212; 7.438; 14.3549 80.834; 85.227; 74.865 | 529.83 | Maier, Lukáš; Khirsariya, Prashant; Hylse, Ondřej; Adla, Santosh Kumar; Černová, Lenka; Poljak, Michal; Krajčovičová, Soňa; Weis, Erik; Drápela, Stanislav; Souček, Karel; Paruch, Kamil Diastereoselective Flexible Synthesis of Carbocyclic C-Nucleosides. The Journal of organic chemistry, 2017, 82, 3382-3402 |
4035341 | CIF | C12 H12 F2 O3 | P 1 21/c 1 | 10.4923; 10.7404; 9.7986 90; 97.835; 90 | 1093.91 | McCarter, Adam W.; Sommer, Magdalena; Percy, Jonathan M.; Jamieson, Craig; Kennedy, Alan R.; Hirst, David J. Atom Efficient Synthesis of Selectively Difluorinated Carbocycles through a Gold(I)-Catalyzed Cyclization. The Journal of organic chemistry, 2018, 83, 8888-8905 |
4025865 | CIF | C12 H12 F3 I O6 | P -1 | 10.195; 12.572; 13.12 89.811; 68.309; 72.842 | 1482.4 | Jarugu Narasimha Moorthy; Kalyan Senapati; Keshaba Nanda Parida 6-Membered Pseudocyclic IBX Acids: Syntheses, X-ray Structural Characterizations, and Oxidation Reactivities in Common Organic Solvents Journal of Organic Chemistry, 2010, 75, 8416-8421 |
4034102 | CIF | C12 H12 F3 N O3 S | P b c a | 7.8786; 10.9544; 29.561 90; 90; 90 | 2551.3 | Nakafuku, Kohki M.; Twumasi, Raymond K.; Vanitcha, Avassaya; Wappes, Ethan A.; Namitharan, Kayambu; Bekkaye, Mathieu; Nagib, David A. Development of an Imine Chaperone for Selective C-H Functionalization of Alcohols via Radical Relay. The Journal of organic chemistry, 2019, 84, 13065-13072 |
4025078 | CIF | C12 H12 I4 N2 O4 | P 1 21/n 1 | 17.1722; 11.5894; 19.7178 90; 103.073; 90 | 3822.4 | Piron, Flavia; Vanthuyne, Nicolas; Joulin, Bérangère; Naubron, Jean-Valère; Cismaş, Crina; Terec, Anamaria; Varga, Richard Attila; Roussel, Christian; Roncali, Jean; Grosu, Ion Synthesis, Structural Analysis, and Chiral Investigations of Some Atropisomers with EE-Tetrahalogeno-1,3-butadiene Core Journal of Organic Chemistry, 2009, 74, 9062-9070 |
4021522 | CIF | C12 H12 N O3 S | P -1 | 6.136; 9.04; 11.057 100.788; 97.355; 92.065 | 596.4 | Devarajulu Sureshkumar; Susama Maity; Srinivasan Chandrasekaran Regio- and Stereoselective Synthesis of Aziridino Epoxides from Cyclic Dienes Journal of Organic Chemistry, 2006, 71, 1653-1657 |
4023320 | CIF | C12 H12 N2 O | P 1 21/c 1 | 8.944; 11.148; 11.494 90; 111.122; 90 | 1069 | Yunfei Du; Junbiao Chang; John Reiner; Kang Zhao Formation of N-Alkoxyindole Framework: Intramolecular Heterocyclization of 3-Alkoxyimino-2-arylalkylnitriles Mediated by Ferric Chloride Journal of Organic Chemistry, 2008, 73, 2007-2010 |
4029650 | CIF | C12 H12 N2 O | C 1 2/c 1 | 17.184; 10.142; 12.177 90; 106.912; 90 | 2030.4 | Zhang, Yan; Zheng, Jing; Cui, Sunliang Rh(III)-Catalyzed C-H Activation/Cyclization of Indoles and Pyrroles: Divergent Synthesis of Heterocycles. The Journal of organic chemistry, 2014, 79, 6490-6500 |
4029920 | CIF | C12 H12 N2 O | P 1 21/n 1 | 12.71; 5.3452; 30.525 90; 95.94; 90 | 2063 | Garg, Parul; Chaudhary, Shweta; Milton, Marilyn D. Synthesis of 2-Aryl/Heteroaryloxazolines from Nitriles under Metal- and Catalyst-Free Conditions and Evaluation of Their Antioxidant Activities. The Journal of organic chemistry, 2014, 79, 8668-8677 |
4034926 | CIF | C12 H12 N2 O | P 1 21/c 1 | 5.0802; 17.971; 10.991 90; 90.471; 90 | 1003.4 | Tojo, Yukiko; Urushibara, Ko; Yamamoto, Sawori; Mori, Hirotoshi; Masu, Hyuma; Kudo, Mayumi; Hirano, Tomoya; Azumaya, Isao; Kagechika, Hiroyuki; Tanatani, Aya Conformational Properties of Aromatic Oligoamides Bearing Pyrrole Rings. The Journal of organic chemistry, 2018, 83, 4606-4617 |
4021357 | CIF | C12 H12 N2 O S2 | P 1 21/n 1 | 14.071; 10.969; 16.968 90; 107.87; 90 | 2492.6 | Akiyuki Hamasaki; Richard Ducray; Dale L. Boger Two Novel 1,2,4,5-Tetrazines that Participate in Inverse Electron Demand Diels-Alder Reactions with an Unexpected Regioselectivity Journal of Organic Chemistry, 2006, 71, 185-193 |
4025361 | CIF | C12 H12 N2 O2 | P -1 | 7.095; 8.508; 9.717 89.029; 75.838; 85.883 | 567.3 | Yusuke Kobayashi; Kosuke Katagiri; Isao Azumaya; Takashi Harayama Trifluoroacetylation-Induced Houben-Hoesch-Type Cyclization of Cyanoacetanilides: Increased Nucleophilicity of CN Groups Journal of Organic Chemistry, 2010, 75, 2741-2744 |
4026636 | CIF | C12 H12 N2 O2 | P 1 21/c 1 | 7.4166; 6.8485; 20.6409 90; 100.035; 90 | 1032.37 | Wei-Ti Chuang; Cheng-Chih Hsieh; Chin-Hung Lai; Cheng-Hsuan Lai; Chun-Wei Shih; Kew-Yu Chen; Wen-Yi Hung; Yu-Hsiang Hsu; Pi-Tai Chou Excited-State Intramolecular Proton Transfer Molecules Bearing o-Hydroxy Analogues of Green Fluorescent Protein Chromophore Journal of Organic Chemistry, 2011, 76, 8189-8202 |
4032295 | CIF | C12 H12 N2 O2 | P 1 21/n 1 | 5.5636; 19.244; 10.159 90; 98.33; 90 | 1076.2 | Zhu, Qiuhua; Ye, Ziwei; Yang, Weijie; Cai, Xiaotie; Tang, Ben Zhong One-Pot Synthesis and Structure-Property Relationship of Aminomaleimides: Fluorescence Efficiencies in Monomers and Aggregates Easily Tuned by Switch of Aryl and Alkyl. The Journal of organic chemistry, 2017, 82, 1096-1104 |
4038213 | CIF | C12 H12 N2 O2 S | P 1 21/c 1 | 13.7763; 7.4726; 12.2799 90; 112.011; 90 | 1172.01 | Helberg, Julian; Ampßler, Torsten; Zipse, Hendrik Pyridinyl Amide Ion Pairs as Lewis Base Organocatalysts. The Journal of organic chemistry, 2020 |
4038220 | CIF | C12 H12 N2 O2 S | P 1 21/c 1 | 10.7237; 14.8564; 14.6583 90; 103.02; 90 | 2275.26 | Helberg, Julian; Ampßler, Torsten; Zipse, Hendrik Pyridinyl Amide Ion Pairs as Lewis Base Organocatalysts. The Journal of organic chemistry, 2020 |
4033078 | CIF | C12 H12 N2 O3 | P 1 21/n 1 | 4.98625; 15.4076; 14.7032 90; 97.361; 90 | 1120.28 | Sączewski, Jarosław; Fedorowicz, Joanna; Gdaniec, Maria; Wiśniewska, Paulina; Sieniawska, Emilia; Drażba, Zuzanna; Rzewnicka, Justyna; Balewski, Łukasz The Elusive Paal-Knorr Intermediates in the Trofimov Synthesis of Pyrroles: Experimental and Theoretical Studies. The Journal of organic chemistry, 2017, 82, 9737-9743 |
4035689 | CIF | C12 H12 N2 O3 | P 1 21/n 1 | 9.7701; 5.8703; 20.14 90; 100.672; 90 | 1135.1 | Szostak, Roman; Liu, Chengwei; Lalancette, Roger; Szostak, Michal Twisted N-Acyl-hydantoins: Rotationally Inverted Urea-Imides of Relevance in N-C(O) Cross-coupling. The Journal of organic chemistry, 2018, 83, 14676-14682 |
4020402 | CIF | C12 H12 N2 O4 | C 1 c 1 | 4.354; 22.74; 12.12 90; 105.022; 90 | 1159 | Yoshihito Ueno; Takumi Kato; Kumiko Sato; Yasutomo Ito; Mahito Yoshida; Takumi Inoue; Aya Shibata; Masahiro Ebihara; Yukio Kitade Synthesis and Properties of Nucleic Acid Analogues Consisting of a Benzene-Phosphate Backbone Journal of Organic Chemistry, 2005, 70, 7925-7935 |
4029469 | CIF | C12 H12 N2 O4 S | P 1 21 1 | 7.7299; 8.0026; 21.4995 90; 91.981; 90 | 1329.15 | Kelley, Brandon T.; Carroll, Patrick; Joullié, Madeleine M Possible Reason for the Unusual Regioselectivity in Nucleophilic Ring Opening of Trisubstituted Aziridines under Mildly Basic Conditions. The Journal of organic chemistry, 2014, 79, 5121-5133 |
4027897 | CIF | C12 H12 N2 O5 | P -1 | 10.908; 11.3838; 11.6457 64.786; 86.639; 72.367 | 1242.7 | Simbarashe Ngwerume; William Lewis; Jason E. Camp Development of a Gold-Multifaceted Catalysis Approach to the Synthesis of Highly Substituted Pyrroles: Mechanistic Insights via Huisgen Cycloaddition Studies Journal of Organic Chemistry, 2013, 78, 920-934 |
4023883 | CIF | C12 H12 N2 S | P 1 21/c 1 | 6.3656; 23.557; 7.7957 90; 108.291; 90 | 1109.9 | Tetsuharu Hori; Yuko Otani; Masatoshi Kawahata; Kentaro Yamaguchi; Tomohiko Ohwada Nonplanar Structures of Thioamides Derived from 7-Azabicyclo[2.2.1]heptane. Electronically Tunable Planarity of Thioamides Journal of Organic Chemistry, 2008, 73, 9102-9108 |
4032129 | CIF | C12 H12 N4 O | P 1 21/c 1 | 18.8598; 6.0858; 9.8418 90; 95.853; 90 | 1123.72 | Aruri, Hariprasad; Singh, Umed; Kumar, Mukesh; Sharma, Sumit; Aithagani, Sravan Kumar; Gupta, Vivek K.; Mignani, Serge; Vishwakarma, Ram A.; Singh, Parvinder Pal Metal-free Cross-Dehydrogenative Coupling of HN-azoles with α-C(sp(3))-H Amides via C-H Activation and Its Mechanistic and Application Studies. The Journal of organic chemistry, 2017, 82, 1000-1012 |
4035519 | CIF | C12 H12 N4 O | P 1 21/n 1 | 9.1723; 9.2651; 13.5282 90; 90.6996; 90 | 1149.57 | Liu, Peiye; Clark, Ronald J.; Zhu, Lei Synthesis of 1-Cyanoalkynes and Their Ruthenium(II)-Catalyzed Cycloaddition with Organic Azides to Afford 4-Cyano-1,2,3-triazoles. The Journal of organic chemistry, 2018, 83, 5092-5103 |
4025050 | CIF | C12 H12 O | P 1 21/n 1 | 7.5594; 13.6697; 9.4364 90; 93.73; 90 | 973.04 | Jing Li; Wangqing Kong; Yihua Yu; Chunling Fu; Shengming Ma Studies on Electrophilic Reaction of Tertiary 2,3-Allenols with NBS in H2O or Aqueous MeCN: An Efficient Selective Synthesis of 2-Bromoallylic Ketones, 1,2-Allenyl Ketones, or 3-Bromo-2,5-dihydrofurans Journal of Organic Chemistry, 2009, 74, 8733-8738 |
4021346 | CIF | C12 H12 O2 | P c a 21 | 15.527; 6.0758; 20.691 90; 90; 90 | 1952 | Fuye Gao; D. Jean Burnell Reactions of 1,2-Bis(trimethylsilyloxy)cycloalkenes with the Diethyl Acetals of Aldehydes Journal of Organic Chemistry, 2006, 71, 356-359 |
4027325 | CIF | C12 H12 O3 | P 21 21 21 | 6.8825; 10.5619; 13.8053 90; 90; 90 | 1003.54 | Day-Shin Hsu; Shih-Chung Lin Total Syntheses of Cladoacetals A and B: Confirmation of Absolute Configurations Journal of Organic Chemistry, 2012, 77, 6139-6146 |
4034370 | CIF | C12 H12 O3 | C 1 2/c 1 | 15.6759; 7.256; 19.3615 90; 111.935; 90 | 2042.84 | John, Jubi; Omanakuttan, Vishnu K.; T, Aneeja; Suresh, Cherumuttathu H.; Jones, Peter G.; Hopf, Henning Tandem α-Arylation/Cyclization of 4-Haloacetoacetates with Arynes: A Metal-Free Approach toward 4-Aryl-3-(2 H)-furanones. The Journal of organic chemistry, 2019, 84, 5957-5964 |
4020225 | CIF | C12 H12 O3 S | P 1 21/c 1 | 6.3998; 22.1292; 8.4297 90; 111.597; 90 | 1110.02 | J. L. García Ruano; Cristina Fajardo; Alberto Fraile; M. Rosario Martín Journal of Organic Chemistry, 2005, 70, 4300-4306 |
4020323 | CIF | C12 H12 O4 | C 1 c 1 | 17.1273; 9.0809; 6.937 90; 104.85; 90 | 1042.88 | María Victoria Roux; Juan Z. Dávalos; Pilar Jiménez; Rafael Notario; Obis Castaño; James S. Chickos; William Hanshaw; Hui Zhao; Nigam Rath; Joel F. Liebman; Behzad S. Farivar; A. Bashir-Hashemi Journal of Organic Chemistry, 2005, 70, 5461-5470 |
4033408 | CIF | C12 H12 O4 | P 1 | 6.807; 12.0906; 13.8845 67.8; 83.447; 73.949 | 1016.69 | Ilie, Adriana; Harms, Klaus; Reetz, Manfred T. P450-Catalyzed Regio- and Stereoselective Oxidative Hydroxylation of 6-Iodotetralone: Preparative-Scale Synthesis of a Key Intermediate for Pd-Catalyzed Transformations. The Journal of organic chemistry, 2018, 83, 7504-7508 |
4034088 | CIF | C12 H12 O4 | P 1 21/c 1 | 9.2862; 6.9345; 16.3887 90; 104.558; 90 | 1021.47 | Singh, Diksha; Kumar, Gangam Srikanth; Kapur, Manmohan Oxazolinyl-Assisted Ru(II)-Catalyzed C-H Allylation with Allyl Alcohols and Synthesis of 4-Methyleneisochroman-1-ones. The Journal of organic chemistry, 2019, 84, 12881-12892 |
4038410 | CIF | C12 H12 O4 | P -1 | 6.7935; 8.8102; 9.8737 101.487; 108.498; 106.224 | 510.53 | Castillo, Juan-Carlos; Castro-Agudelo, Brian; Gálvez, Jaime; Carissan, Yannick; Rodríguez, Jean; Coquerel, Yoann Periselectivity in the aza-Diels-Alder cycloaddition between α-oxoketenes and N-(5-pyrazolyl)imines: a combined experimental and theoretical study. The Journal of organic chemistry, 2020 |
4020365 | CIF | C12 H12 O5 | P 1 21 1 | 10.4273; 9.251; 11.9107 90; 98.884; 90 | 1135.16 | Weiming Luo; Qian-sheng Yu; Harold W. Holloway; Damon Parrish; Nigel H. Greig; Arnold Brossi Journal of Organic Chemistry, 2005, 70, 6171-6176 |
4023156 | CIF | C12 H12 S6 | P 1 | 9.121; 9.651; 18.764 100.96; 101.06; 100.08 | 1552.6 | Takahiro Tsuchiya; Yosuke Okada; Toshio Shimizu; Kazunori Hirabayashi; Nobumasa Kamigata Molecular Transformations of Unsaturated Thiacrown Ethers Journal of Organic Chemistry, 2008, 73, 76-80 |
4030694 | CIF | C12 H13 Br F3 N O2 S | P -1 | 6.9579; 10.516; 10.5474 65.766; 80.838; 77.224 | 684.28 | Yu, Wesley Zongrong; Chen, Feng; Cheng, Yi An; Yeung, Ying-Yeung Catalyst-free and metal-free electrophilic bromoamidation of unactivated olefins using the N-bromosuccinimide/sulfonamide protocol. The Journal of organic chemistry, 2015, 80, 2815-2821 |
4030696 | CIF | C12 H13 Br F3 N O4 S | P 1 21/n 1 | 5.9416; 20.512; 12.1325 90; 97.383; 90 | 1466.4 | Yu, Wesley Zongrong; Chen, Feng; Cheng, Yi An; Yeung, Ying-Yeung Catalyst-free and metal-free electrophilic bromoamidation of unactivated olefins using the N-bromosuccinimide/sulfonamide protocol. The Journal of organic chemistry, 2015, 80, 2815-2821 |
4025139 | CIF | C12 H13 Br N O3 P S | P 1 21/c 1 | 17.2748; 6.4985; 12.8822 90; 103.233; 90 | 1407.8 | Baolu Shi; Alexander J. Blake; William Lewis; Ian B. Campbell; Brian D. Judkins; Christopher J. Moody Rhodium Carbene Routes to Oxazoles and Thiazoles. Catalyst Effects in the Synthesis of Oxazole and Thiazole Carboxylates, Phosphonates, and Sulfones Journal of Organic Chemistry, 2010, 75, 152-161 |
4024958 | CIF | C12 H13 Br2 N | P 1 21/n 1 | 7.2022; 10.808; 15.863 90; 99.586; 90 | 1217.5 | Grant R. Krow; Ram Edupuganti; Deepa Gandla; Amit Choudhary; Guoliang Lin; Philip E. Sonnet; Charles DeBrosse; Charles W. Ross; Kevin C. Cannon; Ronald T. Raines 5(6)-anti-Substituted-2-azabicyclo[2.1.1]hexanes: A Nucleophilic Displacement Route Journal of Organic Chemistry, 2009, 74, 8232-8242 |
4038224 | CIF | C12 H13 Br2 N O4 | I 1 2/c 1 | 12.5491; 8.3129; 26.875 90; 102.001; 90 | 2742.3 | Liu, Renzhi; Yang, Min; Xie, Wenlin; Dong, Wenbi; Zhou, Hongwei; Yadav, Sarita; Potkin, Vladimir Ivanovich; Qiu, Guanyinsheng Synthesis of 3-Hydroxyisoindolin-1-ones Through 1, 4-Dioxane-Mediated Hydroxylhydrative aza-Cyclization of 2-Alkynylbenzamide in Water. The Journal of organic chemistry, 2020 |
4038246 | CIF | C12 H13 Cl N2 O3 | P 1 21 1 | 7.5174; 10.8721; 7.6231 90; 92.3519; 90 | 622.51 | Matsubara, Ryosuke; Ando, Akihiro; Hasebe, Hayu; Kim, Hojin; Tsuneda, Takao; Hayashi, Masahiko Synthesis and Synthetic Application of Chloro- and Bromofuroxans. The Journal of organic chemistry, 2020, 85, 5959-5972 |
4021703 | CIF | C12 H13 Cl N6 | C 1 2/c 1 | 13.449; 20.433; 9.746 90; 107.333; 90 | 2556.8 | Minghong Zhong; Ireneusz Nowak; John F. Cannon; Morris J. Robins Structure and Synthesis of 6-(Substituted-imidazol-1-yl)purines: Versatile Substrates for Regiospecific Alkylation and Glycosylation at N9 Journal of Organic Chemistry, 2006, 71, 4216-4221 |
4038508 | CIF | C12 H13 Cl O2 | P 21 21 21 | 7.2414; 8.1329; 18.752 90; 90; 90 | 1104.4 | Gao, Shenghua; Gao, Xuezhi; Wu, Zenong; Li, Houyong; Yang, Zhezhou; Zhang, Fuli Process for (<i>S</i>)-Ketamine and (<i>S</i>)-Norketamine via Resolution Combined with Racemization. The Journal of organic chemistry, 2020, 85, 8656-8664 |
4025660 | CIF | C12 H13 F N2 O | P 1 21/n 1 | 6.5422; 17.2499; 9.8157 90; 100.007; 90 | 1090.87 | Nitin T. Patil; Anil Kumar Mutyala; Pediredla G. V. V. Lakshmi; Balakrishna Gajula; Balasubramanian Sridhar; Gurava Reddy Pottireddygari; Tadikamalla Prabhakar Rao Au(I)-Catalyzed Cascade Reaction Involving Formal Double Hydroamination of Alkynes Bearing Tethered Carboxylic Groups: An Easy Access to Fused Dihydrobenzimidazoles and Tetrahydroquinazolines Journal of Organic Chemistry, 2010, 75, 5963-5975 |
4026430 | CIF | C12 H13 F N4 O3 | P 21 21 21 | 10.2887; 10.5055; 11.3704 90; 90; 90 | 1229 | Ramon Flores; Albert Rustullet; Ramon Alibés; Angel Álvarez-Larena; Pedro de March; Marta Figueredo; Josep Font Synthesis of Purine Nucleosides Built on a 3-Oxabicyclo[3.2.0]heptane Scaffold Journal of Organic Chemistry, 2011, 76, 5369-5383 |
4029882 | CIF | C12 H13 F3 | P n a 21 | 12.372; 5.7322; 14.47 90; 90; 90 | 1026.2 | Durie, Alastair J.; Fujiwara, Tomoya; Al-Maharik, Nawaf; Slawin, Alexandra M. Z.; O'Hagan, David Stepwise Preparation of All-cis 1,3,4-Trifluoro-2-phenylcyclohexane, Avoiding a Phenonium Intermediate. The Journal of organic chemistry, 2014, 79, 8228-8233 |
4020876 | CIF | C12 H13 I N4 O | P 1 21/n 1 | 11.8157; 8.0795; 14.0426 90; 103.056; 90 | 1305.9 | Chia-Hui Chien; Man-kit Leung; Jen-Kuan Su; Gene-Hsiang Li; Yi-Hung Liu; Yu Wang Substituent Effects on Pyrid-2-yl Ureas toward Intramolecular Hydrogen Bonding and Cytosine Complexation Journal of Organic Chemistry, 2004, 69, 1866-1871 |
4020877 | CIF | C12 H13 I N4 O | P -1 | 7.67; 12.2458; 16.1077 70.079; 87.329; 72.545 | 1354.29 | Chia-Hui Chien; Man-kit Leung; Jen-Kuan Su; Gene-Hsiang Li; Yi-Hung Liu; Yu Wang Substituent Effects on Pyrid-2-yl Ureas toward Intramolecular Hydrogen Bonding and Cytosine Complexation Journal of Organic Chemistry, 2004, 69, 1866-1871 |
4020537 | CIF | C12 H13 I O7 | P -1 | 8.0018; 8.7268; 11.845 91.4834; 107.912; 114.697 | 703.56 | Viktor V. Zhdankin; Alexey Y. Koposov; Dmitry N. Litvinov; Michael J. Ferguson; Robert McDonald; Thanh Luu; Rik R. Tykwinski Esters of 2-iodoxybenzoic acid (IBX-esters): hypervalent iodine oxidizing reagents with a pseudobenziodoxole structure Journal of Organic Chemistry, 2005, 70, 6484-6491 |
4028868 | CIF | C12 H13 N O | P 1 21/n 1 | 10.642; 19.168; 11.125 90; 111.89; 90 | 2105.7 | Naoki Kise; Yusuke Kawano; Toshihiko Sakurai Reductive Coupling of Phthalimides with Ketones and Aldehydes by Low-Valent Titanium: One-Pot Synthesis of Alkylideneisoindolin-1-ones Journal of Organic Chemistry, 2013, 78, 12453-12459 |
4034412 | CIF | C12 H13 N O | P 21 21 21 | 7.39581; 9.46599; 13.8475 90; 90; 90 | 969.44 | Li, Shasha; Zhang, Jinxia; Li, Hongjie; Feng, Lifei; Jiao, Peng Preparation and Application of Amino Phosphine Ligands Bearing Spiro[indane-1,2'-pyrrolidine] Backbone. The Journal of organic chemistry, 2019, 84, 9460-9473 |
4035265 | CIF | C12 H13 N O | P 1 21 1 | 7.0538; 8.4543; 8.3005 90; 99.725; 90 | 487.89 | Qiu, Yun; Dlugosch, Michael; Liu, Xin; Khan, Faiyaz; Ward, Jas S.; Lan, Ping; Banwell, Martin G. Reductive Cyclization of o-Nitroarylated-α,β-unsaturated Aldehydes and Ketones with TiCl<sub>3</sub>/HCl or Fe/HCl Leading to 1,2,3,9-Tetrahydro-4 H-carbazol-4-ones and Related Heterocycles. The Journal of organic chemistry, 2018, 83, 12023-12033 |
4030072 | CIF | C12 H13 N O S | P 1 21/n 1 | 5.262; 16.416; 13.074 90; 99.99; 90 | 1112 | Huang, Fei; Wu, Ping; Wang, Liandi; Chen, Jiping; Sun, Chenglin; Yu, Zhengkun Copper-Mediated Intramolecular Oxidative C-H/C-H Cross-Coupling of α-Oxo Ketene N,S-Acetals for Indole Synthesis. The Journal of organic chemistry, 2014, 79, 10553 |
4021869 | CIF | C12 H13 N O2 | P b c a | 8.634; 10.072; 23.622 90; 90; 90 | 2054 | Scott E. Denmark; Justin I. Montgomery A General Synthesis of N-Vinyl Nitrones Journal of Organic Chemistry, 2006, 71, 6211-6220 |
4034407 | CIF | C12 H13 N O2 | P 41 21 2 | 12.238; 12.238; 13.7036 90; 90; 90 | 2052.37 | Li, Shasha; Zhang, Jinxia; Li, Hongjie; Feng, Lifei; Jiao, Peng Preparation and Application of Amino Phosphine Ligands Bearing Spiro[indane-1,2'-pyrrolidine] Backbone. The Journal of organic chemistry, 2019, 84, 9460-9473 |
4036909 | CIF | C12 H13 N O2 | P 1 21/c 1 | 11.728; 14.884; 6.523 90; 105.23; 90 | 1098.7 | García-Iriepa, Cristina; Ernst, Hanna A.; Liang, Yu; Unterreiner, Andreas-Neil; Frutos, Luis Manuel; Sampedro, Diego Study of Model Systems for Bilirubin and Bilin Chromophores: Determination and Modification of Thermal and Photochemical Properties. The Journal of organic chemistry, 2016, 81, 6292-6302 |
4021751 | CIF | C12 H13 N O3 | P n a 21 | 8.6992; 6.3159; 39.6797 90; 90; 90 | 2180.13 | Fatiah Issa; Joshua Fischer; Peter Turner; Mark J. Coster Regioselective Reduction of 3-Methoxymaleimides: An Efficient Method for the Synthesis of Methyl 5-Hydroxytetramates Journal of Organic Chemistry, 2006, 71, 4703-4705 |
4023134 | CIF | C12 H13 N O3 S2 | P 1 21/c 1 | 6.051; 23.735; 10.436 90; 119.725; 90 | 1301.6 | Flavio Cermola; Annalisa Guaragna; Maria Rosaria Iesce; Giovanni Palumbo; Raffaella Purcaro; Maria Rubino; Angela Tuzi New Insight into the Reaction of Singlet Oxygen with Sulfur-Containing Cyclic Alkenes: Dye-Sensitized Photooxygenation of 5,6-Dihydro-1,4-dithiins Journal of Organic Chemistry, 2007, 72, 10075-10080 |
4025732 | CIF | C12 H13 N O4 | P 1 21 1 | 5.7278; 7.53; 13.217 90; 99.059; 90 | 562.9 | Dengfu Lu; Yajun Li; Yuefa Gong Organocatalytic Asymmetric Tandem Michael Addition-Hemiacetalization: A Route to Chiral Dihydrocoumarins, Chromanes, and 4H-Chromenes Journal of Organic Chemistry, 2010, 75, 6900-6907 |
4027334 | CIF | C12 H13 N O4 | P 21 21 21 | 6.34; 8.649; 21.069 90; 90; 90 | 1155.3 | Aidang Lu; Keling Hu; Youming Wang; Haibin Song; Zhenghong Zhou; Jianxin Fang; Chuchi Tang Enantioselective Synthesis of trans-Dihydrobenzofurans via Primary Amine-Thiourea Organocatalyzed Intramolecular Michael Addition Journal of Organic Chemistry, 2012, 77, 6208-6214 |
4027367 | CIF | C12 H13 N O4 | P 1 21/c 1 | 14.8352; 9.2601; 8.4422 90; 105.966; 90 | 1115.01 | A. Stephen K. Hashmi; Maria Camila Blanco Jaimes; Andreas M. Schuster; Frank Rominger From Propargylic Amides to Functionalized Oxazoles: Domino Gold Catalysis/Oxidation by Dioxygen Journal of Organic Chemistry, 2012, 77, 6394-6408 |
4023110 | CIF | C12 H13 N O5 | P 1 21 1 | 5.63; 6.028; 17.632 90; 92.56; 90 | 597.7 | Xiao-Ying Xu; Zhuo Tang; Yan-Zhao Wang; Shi-Wei Luo; Lin-Feng Cun; Liu-Zhu Gong Asymmetric Organocatalytic Direct Aldol Reactions of Ketones with α-Keto Acids and Their Application to the Synthesis of 2-Hydroxy-γ-butyrolactones Journal of Organic Chemistry, 2007, 72, 9905-9913 |
4022404 | CIF | C12 H13 N S2 | P 1 21/c 1 | 12.802; 11.5375; 17.6364 90; 110.774; 90 | 2435.6 | Katsu Ogawa; Seth C. Rasmussen A Simple and Efficient Route to N-Functionalized Dithieno[3,2-b:2',3'-d]pyrroles: Fused-Ring Building Blocks for New Conjugated Polymeric Systems Journal of Organic Chemistry, 2003, 68, 2921-2928 |
4038189 | CIF | C12 H13 N3 O S2 | P 1 21/c 1 | 10.0149; 15.6728; 8.2966 90; 102.539; 90 | 1271.19 | Chen, Jin-Yu; Selvaraju, Manikandan; Lin, Yen-Tzu; Dhole, Sandip; Lin, Chih-Yu; Sun, Chung-Ming Molecular Iodine-Promoted [3 + 2] Oxidative Cyclization for the Synthesis of Heteroarene-Fused [1,2,4] Thiadiazoles/Selenadiazoles. The Journal of organic chemistry, 2020, 85, 5570-5579 |
4024036 | CIF | C12 H13 N3 O2 | P 1 21/n 1 | 18.767; 10.205; 5.6858 90; 93.557; 90 | 1086.8 | Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport Enols of Substituted Cyanomalonamides Journal of Organic Chemistry, 2007, 72, 5297-5312 |
4024037 | CIF | C12 H13 N3 O2 | P 1 21/n 1 | 20.498; 9.317; 5.9004 90; 93.759; 90 | 1124.4 | Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport Enols of Substituted Cyanomalonamides Journal of Organic Chemistry, 2007, 72, 5297-5312 |
4030650 | CIF | C12 H13 N3 O2 | P 1 21/c 1 | 13.2661; 8.4355; 11.2895 90; 110.075; 90 | 1186.61 | Iaroshenko, Viktor O.; Gevorgyan, Ashot; Mkrtchyan, Satenik; Arakelyan, Knar; Grigoryan, Tatevik; Yedoyan, Julietta; Villinger, Alexander; Langer, Peter Transition-metal-catalyzed arylation of nitroimidazoles and further transformations of manipulable nitro group. The Journal of organic chemistry, 2015, 80, 2103-2119 |
4023014 | CIF | C12 H13 N3 O2 S | P 1 21 1 | 6.0745; 10.601; 9.9223 90; 104.882; 90 | 617.52 | Lara Bianchi; Gianluca Giorgi; Massimo Maccagno; Giovanni Petrillo; Valeria Rocca; Fernando Sancassan; Carlo Scapolla; Elda Severi; Cinzia Tavani Butadienic Building Blocks from 2-Nitrothiophene as Precursors of Nitrogen Heterocycles: Intriguing Dichotomic Behavior Journal of Organic Chemistry, 2007, 72, 9067-9073 |
4024030 | CIF | C12 H13 N3 O3 | P 1 21/c 1 | 18.3407; 5.3308; 12.262 90; 102.161; 90 | 1171.96 | Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport Enols of Substituted Cyanomalonamides Journal of Organic Chemistry, 2007, 72, 5297-5312 |
4024031 | CIF | C12 H13 N3 O3 | P 1 21/c 1 | 18.235; 5.3898; 12.383 90; 102.068; 90 | 1190.1 | Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport Enols of Substituted Cyanomalonamides Journal of Organic Chemistry, 2007, 72, 5297-5312 |
4028237 | CIF | C12 H13 N3 O4 | P 1 21/c 1 | 7.902; 6.4016; 24.337 90; 94.076; 90 | 1228 | Xiao-Jian Li; Jin-Ling Zhang; Yu Geng; Zhong Jin Nickel-Catalyzed Suzuki-Miyaura Coupling of Heteroaryl Ethers with Arylboronic Acids Journal of Organic Chemistry, 2013, 78, 5078-5084 |
4037948 | CIF | C12 H13 N3 O4 | P -1 | 7.797; 8.5423; 9.3211 96.609; 93.905; 91.966 | 614.71 | Pan, Zhengbing; Mao, Kaimin; Zhu, Guangzhou; Wang, Chang; Zhang, Jinpeng; Rong, Liangce Copper-catalyzed Annulation Reaction of Alkenes and N-alkyl(aryl)-1- (methylthio)-2-nitroethenamine: an Approach for the Synthesis of Isoxazole Derivatives. The Journal of organic chemistry, 2020 |
4026429 | CIF | C12 H13 N5 O2 | P 21 21 21 | 4.7721; 8.0365; 31.58 90; 90; 90 | 1211.1 | Ramon Flores; Albert Rustullet; Ramon Alibés; Angel Álvarez-Larena; Pedro de March; Marta Figueredo; Josep Font Synthesis of Purine Nucleosides Built on a 3-Oxabicyclo[3.2.0]heptane Scaffold Journal of Organic Chemistry, 2011, 76, 5369-5383 |
4028379 | CIF | C12 H13 O3 S | P 21 21 21 | 6.6358; 6.8047; 25.913 90; 90; 90 | 1170.09 | Gang Wang; Xia Chen; Gaohan Miao; Weijun Yao; Cheng Ma Divergent NHC-Catalyzed Oxidative Transformations of 3-Bromoenal: Selective Synthesis of 2H-Pyran-2-ones and Chiral Dihydropyranones Journal of Organic Chemistry, 2013, 78, 6223-6232 |
4020350 | CIF | C12 H13.33 Cl0.67 N2 O0.67 | P 21 21 21 | 5.5724; 12.1744; 24.426 90; 90; 90 | 1657 | Mark S. Kerr; Javier Read de Alaniz; Tomislav Rovis Journal of Organic Chemistry, 2005, 70, 5725-5728 |
4038601 | CIF | C12 H14 B Cl3 N4 O2 S | P 1 21/n 1 | 8.303; 9.935; 21.623 90; 97.49; 90 | 1768.5 | Suzuki, Yota; Ikeda, Ayumi; Ohno, Keiji; Fujihara, Takashi; Sugaya, Tomoaki; Ishihara, Koji <i>o</i>-Azophenylboronic Acid-Based Colorimetric Sensors for d-Fructose: <i>o</i>-Azophenylboronic Acids with Inserted Protic Solvent Are the Key Species for a Large Color Change. The Journal of organic chemistry, 2020 |
4025748 | CIF | C12 H14 Br N O | P 1 21 1 | 8.3725; 13.1128; 11.2624 90; 90.6624; 90 | 1236.38 | Yakup Güneş; M. Fatih Polat; Ertan Sahin; Fraser F. Fleming; Ramazan Altundas Enantioselective Synthesis of Cyclic, Quaternary Oxonitriles Journal of Organic Chemistry, 2010, 75, 7092-7098 |
4026255 | CIF | C12 H14 Br2 O6 | P 1 21/c 1 | 6.928; 8.502; 25.635 90; 95.193; 90 | 1503.8 | Faiz Ahmed Khan; Ch. Nageswara Rao Grob Fragmentation of Norbornyl α-Diketones: A Route to α-Ketoenols and Aromatic Compounds Journal of Organic Chemistry, 2011, 76, 3320-3328 |
4029548 | CIF | C12 H14 Cl N O4 | P 1 21/c 1 | 9.9985; 7.1946; 17.939 90; 94.453; 90 | 1286.6 | Avery, Thomas D.; Greatrex, Ben W.; Pedersen, Daniel Sejer; Taylor, Dennis K.; Tiekink, Edward R. T. A concise route to beta-Cyclopropyl amino acids utilizing 1,2-dioxines and stabilized phosphonate nucleophiles. The Journal of organic chemistry, 2008, 73, 2633-2640 |
4028410 | CIF | C12 H14 Cl N3 O | P -1 | 8.1929; 12.7166; 12.7229 108.994; 94.057; 96.092 | 1238.5 | Tjøstil Vlaar; Pieter Mampuys; Madeleine Helliwell; Bert U. W. Maes; Romano V. A. Orru; Eelco Ruijter Multicomponent Synthesis of 4-Aminophthalazin-1(2H)-ones by Palladium-Catalyzed Isocyanide Insertion Journal of Organic Chemistry, 2013, 78, 6735-6745 |
4027557 | CIF | C12 H14 Cl3 N O3 | P 1 21/a 1 | 9.7962; 10.5984; 13.7503 90; 90.062; 90 | 1427.61 | Masruri; Anthony C. Willis; Malcolm D. McLeod Osmium-Catalyzed Vicinal Oxyamination of Alkenes by N-(4-Toluenesulfonyloxy)carbamates Journal of Organic Chemistry, 2012, 77, 8480-8491 |
4029540 | CIF | C12 H14 Cu N4 O5 S2 | P 1 21/n 1 | 7.243; 15.003; 15.073 90; 94.955; 90 | 1631.8 | Han, Hoon; Park, Seong Byeong; Kim, Sang Kyu; Chang, Sukbok Copper-nitrenoid formation and transfer in catalytic olefin aziridination utilizing chelating 2-pyridylsulfonyl moieties. The Journal of organic chemistry, 2008, 73, 2862-2870 |
4021108 | CIF | C12 H14 F N O3 | P 1 21/c 1 | 13.994; 8.865; 13.764 90; 42.472; 90 | 1153 | Naoki Kise; Kengo Ohya; Kie Arimoto; Yutaka Yamashita; Yuuki Hirano; Tadahiro Ono; Nasuo Ueda Electroreductive Intramolecular Coupling of Aromatic β- and γ-Imino Esters: A New Synthetic Method for N-Alkoxycarbonyl-2-aryl-3-ones and cis-2-Aryl-3-ols of Pyrrolidines and Piperidines Journal of Organic Chemistry, 2004, 69, 7710-7719 |
4020247 | CIF | C12 H14 F12 N2 P2 | P n m a | 14.4612; 11.6741; 10.6275 90; 90; 90 | 1794.2 | Feihe Huang; Karen A. Switek; Lev N. Zakharov; Frank R. Fronczek; Carla Slebodnick; Matthew Lam; James A. Golen; William S. Bryant; Philip E. Mason; Arnold L. Rheingold; Ashraf-Khorassani, Mehdi; Harry W. Gibson Cryptands, Powerful Hosts for Paraquat Derivatives Journal of Organic Chemistry, 2005, 70, 3231-3241 |
4034012 | CIF | C12 H14 F3 N O2 | P 1 21 1 | 15.4743; 5.3473; 15.7831 90; 91.454; 90 | 1305.56 | Chen, Mu-Wang; Yang, Qin; Deng, Zhihong; Ding, Qiuping; Peng, Yiyuan Synthesis of Chiral β-Fluoroalkyl β-Amino Acid Derivatives via Palladium-Catalyzed Hydrogenation. The Journal of organic chemistry, 2019, 84, 10371-10379 |
4036691 | CIF | C12 H14 F4 O7 | P 1 21/c 1 | 19.9933; 10.6809; 15.059 90; 110.869; 90 | 3004.8 | Golten, Samuel; Fontenelle, Clément Q; Timofte, Roxana S.; Bailac, Laura; Light, Mark; Sebban, Muriel; Oulyadi, Hassan; Linclau, Bruno Enantioselective Synthesis of Dideoxy-tetrafluorinated Hexoses. The Journal of organic chemistry, 2016, 81, 4434-4453 |
4032135 | CIF | C12 H14 N O9 | P 1 21/c 1 | 16.1787; 7.8957; 11.6365 90; 105.489; 90 | 1432.5 | Huang, Shengdian; Paletta, Joseph T.; Elajaili, Hanan; Huber, Kirby; Pink, Maren; Rajca, Suchada; Eaton, Gareth R.; Eaton, Sandra S.; Rajca, Andrzej Synthesis and Electron Spin Relaxation of Tetracarboxylate Pyrroline Nitroxides. The Journal of organic chemistry, 2017, 82, 1538-1544 |
4025225 | CIF | C12 H14 N2 O | P -1 | 7.0615; 10.5166; 15.2154 87.908; 78.661; 72.122 | 1054.04 | Nitin T. Patil; Rahul D. Kavthe; Vivek S. Raut; Valmik S. Shinde; Balasubramanian Sridhar Gold- and Platinum-Catalyzed Formal Markownikoff's Double Hydroamination of Alkynes: A Rapid Access to Tetrahydroquinazolinones and Angularly-Fused Analogues Thereof Journal of Organic Chemistry, 2010, 75, 1277-1280 |
4025659 | CIF | C12 H14 N2 O | P 1 21/n 1 | 7.2069; 12.8071; 11.4143 90; 99.088; 90 | 1040.31 | Nitin T. Patil; Anil Kumar Mutyala; Pediredla G. V. V. Lakshmi; Balakrishna Gajula; Balasubramanian Sridhar; Gurava Reddy Pottireddygari; Tadikamalla Prabhakar Rao Au(I)-Catalyzed Cascade Reaction Involving Formal Double Hydroamination of Alkynes Bearing Tethered Carboxylic Groups: An Easy Access to Fused Dihydrobenzimidazoles and Tetrahydroquinazolines Journal of Organic Chemistry, 2010, 75, 5963-5975 |
4020017 | CIF | C12 H14 N2 O2 | P 1 21/c 1 | 12.6; 6.37; 14.56 90; 98.771; 90 | 1155 | Francesca Aulenta; Michael G.B. Drew; Alison Foster; Wayne Hayes; Steven Rannard; David W. Thornthwaite; David R. Worrall; Tristan G.A. Youngs Journal of Organic Chemistry, 2005, 70, 63-78 |
4025579 | CIF | C12 H14 N2 O2 | I 1 2/a 1 | 16.015; 5.4583; 25.143 90; 99.848; 90 | 2165.5 | Anthony W. Hill; Mark R. J. Elsegood; Marc C. Kimber An Intermolecular Hydroamination of Allenamides with Arylamines Catalyzed by Cationic Au(I) Salts Journal of Organic Chemistry, 2010, 75, 5406-5409 |
4036310 | CIF | C12 H14 N2 O2 | P -1 | 7.7458; 8.3388; 9.2703 77.293; 68.194; 84.734 | 542.28 | Chaiyaveij, Duangduan; Batsanov, Andrei S.; Fox, Mark A.; Marder, Todd B.; Whiting, Andrew An Experimental and Computational Approach to Understanding the Reactions of Acyl Nitroso Compounds in [4 + 2] Cycloadditions. The Journal of organic chemistry, 2015, 80, 9518-9534 |
4037299 | CIF | C12 H14 N2 O3 | P 1 21/n 1 | 15.2093; 4.0297; 18.2902 90; 90.067; 90 | 1120.99 | Chan, Chieh-Kai; Tsai, Yu-Lin; Chan, Yi-Ling; Chang, Meng-Yang Synthesis of Substituted 2,3-Benzodiazepines. The Journal of organic chemistry, 2016, 81, 9836-9847 |
4028577 | CIF | C12 H14 N2 O3 S3 | P -1 | 7.4176; 9.5552; 10.6426 73.5374; 71.7067; 89.4121 | 684.26 | Matthias D. Mertens; Markus Pietsch; Gregor Schnakenburg; Michael Gütschow Regioselective Sulfonylation and N- to O-Sulfonyl Migration of Quinazolin-4(3H)-ones and Analogous Thienopyrimidin-4(3H)-ones Journal of Organic Chemistry, 2013, 78, 8966-8979 |
4034827 | CIF | C12 H14 N2 O3 Se | P 1 21/n 1 | 7.1388; 18.695; 10.5157 90; 104.938; 90 | 1356 | Shangpliang, O. Risuklang; Kshiar, Baskhemlang; Wanniang, Kmendashisha; Marpna, Ibakyntiew D.; Lipon, Tyrchain Mitre; Laloo, Badaker M.; Myrboh, Bekington Selenium Dioxide As an Alternative Reagent for the Direct α-Selenoamidation of Aryl Methyl Ketones. The Journal of organic chemistry, 2018, 83, 5829-5835 |
4038214 | CIF | C12 H14 N2 O4 S | P 1 21/n 1 | 7.1584; 8.4697; 21.076 90; 94.45; 90 | 1273.98 | Helberg, Julian; Ampßler, Torsten; Zipse, Hendrik Pyridinyl Amide Ion Pairs as Lewis Base Organocatalysts. The Journal of organic chemistry, 2020 |
4036405 | CIF | C12 H14 N2 O4 S2 | P -1 | 7.2854; 8.4243; 12.9967 100.849; 94.925; 113.418 | 707.36 | Barany, George; Britton, Doyle; Chen, Lin; Hammer, Robert P.; Henley, Matthew J.; Schrader, Alex M.; Young, Jr, Victor G Unexpectedly Stable (Chlorocarbonyl)(N-ethoxycarbonylcarbamoyl)disulfane, and Related Compounds That Model the Zumach-Weiss-Kühle (ZWK) Reaction for Synthesis of 1,2,4-Dithiazolidine-3,5-diones. The Journal of organic chemistry, 2015, 80, 11313-11321 |
4024121 | CIF | C12 H14 N2 O6 | P 1 21/c 1 | 10.4534; 14.3766; 9.4672 90; 114.346; 90 | 1296.25 | Anjan Patel; Falk Liebner; Thomas Netscher; Kurt Mereiter; Thomas Rosenau Vitamin E Chemistry. Nitration of Non-α-tocopherols: Products and Mechanistic Considerations Journal of Organic Chemistry, 2007, 72, 6504-6512 |
4029314 | CIF | C12 H14 N2 O7 | P 1 21 1 | 12.8822; 9.5928; 22.444 90; 103.587; 90 | 2695.9 | Pandey, Anil K.; Yap, Glenn P. A.; Zondlo, Neal J. (2S,4R)-4-Hydroxyproline(4-nitrobenzoate): Strong Induction of Stereoelectronic Effects via a Readily Synthesized Proline Derivative. Crystallographic Observation of a Correlation between Torsion Angle and Bond Length in a Hyperconjugative Interaction. The Journal of organic chemistry, 2014, 79, 4174-4179 |
4024653 | CIF | C12 H14 N4 | P -1 | 9.8729; 9.9187; 18.54 82.15; 79.402; 80.603 | 1750 | Yan Li; Brian O. Patrick; David Dolphin Near-Infrared Absorbing Azo Dyes: Synthesis and X-ray Crystallographic and Spectral Characterization of Monoazopyrroles, Bisazopyrroles, and a Boron-Azopyrrole Complex Journal of Organic Chemistry, 2009, 74, 5237-5243 |
4035291 | CIF | C12 H14 N6 | P 1 21/m 1 | 8.5723; 7.0541; 10.5423 90; 103.424; 90 | 620.07 | Pathare, Ramdas S.; Ansari, Arshad J.; Verma, Sarika; Maurya, Anand; Maurya, Antim K.; Agnihotri, Vijai K.; Sharon, Ashoke; Pardasani, Ram T.; Sawant, Devesh M. Sequential Pd(0)/Fe(III) Catalyzed Azide-Isocyanide Coupling/Cyclization Reaction: One-Pot Synthesis of Aminotetrazoles. The Journal of organic chemistry, 2018, 83, 9530-9537 |
4025064 | CIF | C12 H14 O2 | I 41/a :2 | 26.262; 26.262; 5.8835 90; 90; 90 | 4057.8 | Christian Brand; Gesche Rauch; Michele Zanoni; Birger Dittrich; Daniel B. Werz Synthesis of [n,5]-Spiroketals by Ring Enlargement of Donor-Acceptor-Substituted Cyclopropane Derivatives Journal of Organic Chemistry, 2009, 74, 8779-8786 |
4034494 | CIF | C12 H14 O2 S4 | P -1 | 11.186; 11.4071; 13.4875 66.629; 86.938; 62.124 | 1377.9 | Li, Yingchun; Zhai, Weixiang; Liao, Yongfang; Nie, Jiangping; Han, Guifang; Song, Yuguang; Li, Shaoyong; Hou, Jingli; Liu, Yangping Synthesis of Central Chirality-Containing Triarylmethanols and Triarylmethyl Radicals with Extraordinarily Stable Configurations. The Journal of organic chemistry, 2019, 84, 11774-11782 |
4021736 | CIF | C12 H14 O3 | P 1 21/c 1 | 9.5109; 9.1849; 12.3031 90; 100.176; 90 | 1057.85 | David Crich; Daniel Grant; Donald J. Wink Expedient Two-Step Synthesis of Phenolic Cyclitols from Benzene Journal of Organic Chemistry, 2006, 71, 4521-4524 |
4034916 | CIF | C12 H14 O3 | P 21 21 21 | 5.8015; 7.985; 22.001 90; 90; 90 | 1019.2 | Yaremenko, Ivan A.; Gomes, Gabriel Dos Passos; Radulov, Peter S.; Belyakova, Yulia Yu; Vilikotskiy, Anatoliy E.; Vil', Vera A.; Korlyukov, Alexander A.; Nikishin, Gennady I.; Alabugin, Igor V.; Terent'ev, Alexander O. Ozone-Free Synthesis of Ozonides: Assembling Bicyclic Structures from 1,5-Diketones and Hydrogen Peroxide. The Journal of organic chemistry, 2018, 83, 4402-4426 |
4031157 | CIF | C12 H14 O4 | P 1 21/c 1 | 15.7456; 11.6139; 14.381 90; 115.775; 90 | 2368.2 | Mahendar, Lodi; Satyanarayana, Gedu Domino One-Pot Process for the Synthesis of Isobenzofuran-1(3H)-ones via [Cu]-Catalysis Using Water as the Green Solvent. The Journal of organic chemistry, 2015, 80, 7089-7098 |
4024433 | CIF | C12 H14 O4 S | C 1 2/c 1 | 20.235; 7.9255; 16.7147 90; 109.567; 90 | 2525.8 | Chao Zhou; Zhao Fang; Chunling Fu; Shengming Ma Highly Regio- and Stereoselective Oxidative Hydroacetoxylation of 1,2-Allenylic Sulfoxides via a Different Mechanism Journal of Organic Chemistry, 2009, 74, 2887-2890 |
4025630 | CIF HKL | C12 H14 O4 S | P 1 21/n 1 | 6.713; 8.3292; 21.452 90; 94.835; 90 | 1195.2 | Florenci V. González; Amit Jain; Santiago Rodríguez; José A. Sáez; Cristian Vicent; Gabriel Peris Stereoisomerization of β-Hydroxy-α-sulfenyl-γ-butyrolactones Controlled by Two Concomitant 1,4-Type Nonbonded Sulfur-Oxygen Interactions As Analyzed by X-ray Crystallography Journal of Organic Chemistry, 2010, 75, 5888-5894 |
4025632 | CIF | C12 H14 O4 S | P 1 21 1 | 9.733; 5.6544; 11.165 90; 93.49; 90 | 613.3 | Florenci V. González; Amit Jain; Santiago Rodríguez; José A. Sáez; Cristian Vicent; Gabriel Peris Stereoisomerization of β-Hydroxy-α-sulfenyl-γ-butyrolactones Controlled by Two Concomitant 1,4-Type Nonbonded Sulfur-Oxygen Interactions As Analyzed by X-ray Crystallography Journal of Organic Chemistry, 2010, 75, 5888-5894 |
4036016 | CIF | C12 H14 O5 | P 1 21 1 | 6.7672; 11.7433; 7.7423 90; 112.125; 90 | 569.97 | Lazzara, Nicholas C.; Rosano, Robert J.; Vagadia, Purav P.; Giovine, Matthew T.; Bezpalko, Mark W.; Piro, Nicholas A.; Kassel, Wm Scott; Boyko, Walter J.; Zubris, Deanna L.; Schrader, Kevin K.; Wedge, David E.; Duke, Stephen O.; Giuliano, Robert M. Synthesis and Biological Evaluation of 6-[(1 R)-1-Hydroxyethyl]-2,4a( R),6( S),8a( R)-tetrahydropyrano-[3,2- b]-pyran-2-one and Structural Analogues of the Putative Structure of Diplopyrone. The Journal of organic chemistry, 2019, 84, 666-678 |
4027237 | CIF | C12 H14 O5 S | P 1 21 1 | 4.8321; 21.157; 6.4661 90; 95.816; 90 | 657.64 | Antonio Latorre; Irakusne López; Victoria Ramírez; Santiago Rodríguez; Javier Izquierdo; Florenci V. González; Cristian Vicent Radical Mechanism in the Elimination of 2-Arylsulfinyl Esters Journal of Organic Chemistry, 2012, 77, 5191-5197 |
4033647 | CIF | C12 H14 O5 S2 | P 21 21 21 | 5.4276; 15.5769; 15.8835 90; 90; 90 | 1342.87 | Mear, Sarah Jane; Jamison, Timothy F. Diazotization of S-Sulfonyl-cysteines The Journal of Organic Chemistry, 2019 |
4023698 | CIF | C12 H14 O6 S | P 1 21/n 1 | 10.055; 12.797; 10.247 90; 92.85; 90 | 1316.9 | Stéphane Perreault; Maude Poirier; Pascal Léviellé; Olivier René; Pascal Joly; Yves Dory; Claude Spino Mechanism and Regioselectivity of the Cycloaddition of Thiones Derived from Meldrum's Acid, Malonates, or Other Dicarbonyls Journal of Organic Chemistry, 2008, 73, 7457-7466 |
4021040 | CIF | C12 H14 O7 | P 1 21 1 | 6.6752; 10.3589; 8.709 90; 91.698; 90 | 601.94 | Roland Messer; Andrea Schmitz; Luzia Moesch; Robert Häner Elaboration of D-(-)-Ribose into a Tricyclic, Natural Product-like Scaffold Journal of Organic Chemistry, 2004, 69, 8558-8560 |
4030756 | CIF | C12 H15 Br N2 O | P 1 | 9.3644; 11.804; 11.909 65.119; 89.81; 89.633 | 1194.2 | Fandrick, Keith R.; Mulder, Jason A.; Patel, Nitinchandra D.; Gao, Joe; Konrad, Michael; Archer, Elizabeth; Buono, Frederic G.; Duran, Adil; Schmid, Rolf; Daeubler, Juergen; Desrosiers, Jean-Nicolas; Zeng, Xingzhong; Rodriguez, Sonia; Ma, Shengli; Qu, Bo; Li, Zhibin; Fandrick, Daniel R.; Grinberg, Nelu; Lee, Heewon; Bosanac, Todd; Takahashi, Hidenori; Chen, Zhidong; Bartolozzi, Alessandra; Nemoto, Peter; Busacca, Carl A.; Song, Jinhua J.; Yee, Nathan K.; Mahaney, Paige E.; Senanayake, Chris H. Development of an Asymmetric Synthesis of a Chiral Quaternary FLAP Inhibitor. The Journal of organic chemistry, 2015, 80, 1651-1660 |
4038245 | CIF | C12 H15 Br N2 O2 | P 1 21/m 1 | 9.2209; 6.6668; 9.3831 90; 99.2121; 90 | 569.376 | Matsubara, Ryosuke; Ando, Akihiro; Hasebe, Hayu; Kim, Hojin; Tsuneda, Takao; Hayashi, Masahiko Synthesis and Synthetic Application of Chloro- and Bromofuroxans. The Journal of organic chemistry, 2020, 85, 5959-5972 |
4022038 | CIF | C12 H15 Cl O3 | P 1 21 1 | 6.4818; 9.578; 8.9682 90; 91.9; 90 | 556.47 | Jollie D. Godfrey, Jr.; Rita T. Fox; Frederic G. Buono; Jack Z. Gougoutas; Mary F. Malley Novel 1,4-Homofragmentation via an α-Lactone Journal of Organic Chemistry, 2006, 71, 8647-8650 |
4023725 | CIF | C12 H15 Cl3 N O5 P | P 21 21 21 | 8.791; 9.756; 19.194 90; 90; 90 | 1646.2 | Diederica D. Claeys; Kristof Moonen; Bart I. Roman; Victor N. Nemykin; Viktor V. Zhdankin; Michel Waroquier; Veronique Van Speybroeck; Christian V. Stevens Synthesis of Tricyclic Phosphonopyrrolidines via IMDAF: Experimental and Theoretical Investigation of the Observed Stereoselectivity Journal of Organic Chemistry, 2008, 73, 7921-7927 |
4023726 | CIF | C12 H15 Cl3 N O5 P | P 1 21 1 | 5.709; 15.564; 9.005 90; 95.57; 90 | 796.4 | Diederica D. Claeys; Kristof Moonen; Bart I. Roman; Victor N. Nemykin; Viktor V. Zhdankin; Michel Waroquier; Veronique Van Speybroeck; Christian V. Stevens Synthesis of Tricyclic Phosphonopyrrolidines via IMDAF: Experimental and Theoretical Investigation of the Observed Stereoselectivity Journal of Organic Chemistry, 2008, 73, 7921-7927 |
4027233 | CIF | C12 H15 F N2 O4 | C 1 2 1 | 20.0342; 8.4347; 6.9512 90; 95.392; 90 | 1169.43 | Punit P. Seth; Jinghua Yu; Ali Jazayeri; Pradeep S. Pallan; Charles R Allerson; Michael E. Østergaard; Fengwu Liu; Piet Herdewijn; Martin Egli; Eric E. Swayze Synthesis and Antisense Properties of Fluoro Cyclohexenyl Nucleic Acid (F-CeNA), a Nuclease Stable Mimic of 2'-Fluoro RNA Journal of Organic Chemistry, 2012, 77, 5074-5085 |
4029039 | CIF | C12 H15 F N2 O5 | P 21 21 21 | 6.1167; 13.975; 14.558 90; 90; 90 | 1244.4 | Dugovic, Branislav; Leumann, Christian J. A 6'-Fluoro-Substituent in Bicyclo-DNA Increases Affinity to Complementary RNA Presumably by CF-HC Pseudohydrogen Bonds. The Journal of organic chemistry, 2014, 79, 1271 |
4021771 | CIF | C12 H15 F O | P c a 21 | 14.3874; 5.6698; 24.607 90; 90; 90 | 2007.3 | Susan B. Billings; K. A. Woerpel Nucleophilic Substitution Reactions of Sulfur-Substituted Cyclohexanone Acetals: An Analysis of the Factors Controlling Stereoselectivity Journal of Organic Chemistry, 2006, 71, 5171-5178 |
4022863 | CIF | C12 H15 F O2 S | P 1 21/c 1 | 7.7348; 9.2886; 16.28 90; 101.646; 90 | 1145.6 | Weike Su; Jiuxi Chen; Huayue Wu; Can Jin A General and Efficient Method for the Selective Synthesis of β-Hydroxy Sulfides and β-Hydroxy Sulfoxides Catalyzed by Gallium(III) Triflate Journal of Organic Chemistry, 2007, 72, 4524-4527 |
4025866 | CIF | C12 H15 I O4 | P -4 21 c | 18.283; 18.283; 7.148 90; 90; 90 | 2389.3 | Jarugu Narasimha Moorthy; Kalyan Senapati; Keshaba Nanda Parida 6-Membered Pseudocyclic IBX Acids: Syntheses, X-ray Structural Characterizations, and Oxidation Reactivities in Common Organic Solvents Journal of Organic Chemistry, 2010, 75, 8416-8421 |
4027679 | CIF | C12 H15 N O | P 1 21/a 1 | 12.0179; 7.871; 12.0993 90; 115.665; 90 | 1031.59 | Agnieszka Witosińska; Bogdan Musielak; Paweł Serda; Maria Owińska; Barbara Rys Conformation of Eight-Membered Benzoannulated Lactams by Combined NMR and DFT Studies Journal of Organic Chemistry, 2012, 77, 9784-9794 |
4032813 | CIF | C12 H15 N O | P 1 21/n 1 | 10.5537; 8.9576; 11.7956 90; 113.549; 90 | 1022.2 | Tang, Mi; Sun, Rengwei; Li, Hao; Yu, Xinhong; Wang, Wei An Unconventional Redox Cross Claisen Condensation-Aromatization of 4-Hydroxyprolines with Ketones. The Journal of organic chemistry, 2017, 82, 8419-8425 |
4037052 | CIF | C12 H15 N O | P 1 21/c 1 | 7.9239; 16.055; 8.1077 90; 100.693; 90 | 1013.54 | Runyon, Scott P.; Kormos, Chad M.; Gichinga, Moses G.; Mascarella, S. Wayne; Navarro, Hernán A; Deschamps, Jeffrey R.; Imler, Gregory H.; Carroll, F. Ivy Design, Synthesis, and Biological Evaluation of Structurally Rigid Analogues of 4-(3-Hydroxyphenyl)piperidine Opioid Receptor Antagonists. The Journal of organic chemistry, 2016, 81, 10383-10391 |
4023881 | CIF | C12 H15 N O S | P 21 21 21 | 5.6481; 13.449; 14.691 90; 90; 90 | 1116 | Tetsuharu Hori; Yuko Otani; Masatoshi Kawahata; Kentaro Yamaguchi; Tomohiko Ohwada Nonplanar Structures of Thioamides Derived from 7-Azabicyclo[2.2.1]heptane. Electronically Tunable Planarity of Thioamides Journal of Organic Chemistry, 2008, 73, 9102-9108 |
4021304 | CIF | C12 H15 N O2 | P 1 21/n 1 | 12.3047; 6.3689; 13.238 90; 96.223; 90 | 1031.3 | Hongbin Li; Hua Yang; Jeffrey L. Petersen; Kung K. Wang Biradicals/Zwitterions from Thermolysis of Enyne-Isocyanates. Application to the Synthesis of 2(1H)-Pyridones, Benzofuro[3,2-c]pyridin-1(2H)-ones, 2,5-Dihydro-1H-pyrido[4,3-b]indol-1-ones, and Related Compounds. Journal of Organic Chemistry, 2004, 69, 4500-4508 |
4020424 | CIF | C12 H15 N O3 | P n m a | 16.8651; 8.9696; 7.6142 90; 90; 90 | 1151.8 | Shengming Ma; Zhenhua Gu; Zhanqian Yu Journal of Organic Chemistry, 2005, 70, 6291-6294 |
4020664 | CIF | C12 H15 N O3 | P -1 | 8.4864; 8.5814; 8.6437 98.452; 101.45; 114.134 | 544.4 | Yong-Hua Yang; Min Shi Ring-Expanding Reaction of Cyclopropyl Amides with Triphenylphosphine and Carbon Tetrahalide Journal of Organic Chemistry, 2005, 70, 8645-8648 |
4020777 | CIF | C12 H15 N O3 | P 1 21/c 1 | 10.4813; 11.9342; 9.7556 90; 106.066; 90 | 1172.63 | F. Christopher Pigge; John J. Coniglio; Nigam P. Rath Functionalized Spiro- and Fused-Ring Heterocycles via Oxidative Demetalation of Cyclohexadienyl Ruthenium Complexes Journal of Organic Chemistry, 2004, 69, 1161-1168 |
4021106 | CIF | C12 H15 N O3 | P 1 21/c 1 | 13.831; 8.845; 13.595 90; 42.811; 90 | 1130.2 | Naoki Kise; Kengo Ohya; Kie Arimoto; Yutaka Yamashita; Yuuki Hirano; Tadahiro Ono; Nasuo Ueda Electroreductive Intramolecular Coupling of Aromatic β- and γ-Imino Esters: A New Synthetic Method for N-Alkoxycarbonyl-2-aryl-3-ones and cis-2-Aryl-3-ols of Pyrrolidines and Piperidines Journal of Organic Chemistry, 2004, 69, 7710-7719 |
4038329 | CIF | C12 H15 N O3 | P 21 21 21 | 5.4777; 8.3194; 25.6879 90; 90; 90 | 1170.63 | Schnitzer, Tobias; Wennemers, Helma Deactivation of Secondary Amine Catalysts via Aldol Reaction-Amine Catalysis under Solvent-Free Conditions. The Journal of organic chemistry, 2020 |
4020288 | CIF | C12 H15 N O4 | P 21 21 21 | 6.6205; 10.695; 16.226 90; 90; 90 | 1148.9 | Stephen Hanessian; Martin Tremblay; Mauro Marzi; Juan R. Del Valle Journal of Organic Chemistry, 2005, 70, 5070-5085 |
4024120 | CIF | C12 H15 N O4 | P -1 | 6.7561; 9.35; 9.6965 108.101; 91.717; 96.312 | 577.4 | Anjan Patel; Falk Liebner; Thomas Netscher; Kurt Mereiter; Thomas Rosenau Vitamin E Chemistry. Nitration of Non-α-tocopherols: Products and Mechanistic Considerations Journal of Organic Chemistry, 2007, 72, 6504-6512 |
4034760 | CIF | C12 H15 N O4 | P 21 21 21 | 8.4894; 11.0722; 12.8612 90; 90; 90 | 1208.91 | Spindler, Benedikt; Kataeva, Olga; Knölker, Hans-Joachim Enantioselective Total Synthesis and Assignment of the Absolute Configuration of the Furo[3,2- a]carbazole Alkaloid Furoclausine-B. The Journal of organic chemistry, 2018, 83, 15136-15143 |
4038138 | CIF | C12 H15 N O4 S | P 1 21/n 1 | 15.8628; 10.9634; 16.5749 90; 117.617; 90 | 2554.1 | Yuan, Yang; Chen, Bo; Zhang, Youcan; Wu, Xiao-Feng Pd/C-Catalyzed Carbonylative Synthesis of α-Carbonyl-α'-Amide Sulfoxonium Ylides from Azides. The Journal of organic chemistry, 2020 |
4024314 | CIF | C12 H15 N O5 | P 1 21/c 1 | 12.4729; 6.9341; 14.2423 90; 108.414; 90 | 1168.7 | Ai Ito; Hideaki Muratake; Koichi Shudo On the Structure of 5-Nitrosotropolone Journal of Organic Chemistry, 2009, 74, 1275-1281 |
4023178 | CIF | C12 H15 N O6 | P 1 21 1 | 5.214; 6.055; 19.48 90; 93.31; 90 | 614 | Kazuteru Usui; Mariko Aso; Mitsuhiro Fukuda; Hiroshi Suemune Photochemical Generation of Oligodeoxynucleotide Containing a C4'-Oxidized Abasic Site and Its Efficient Amine Modification: Dependence on Structure and Microenvironment Journal of Organic Chemistry, 2008, 73, 241-248 |
4023099 | CIF | C12 H15 N O8 S | P 1 21 1 | 10.2966; 6.4115; 10.7707 90; 98.091; 90 | 703.97 | Alessandra Cordeiro; María Luisa Jimeno; Miguel A. Maestro; María-José Camarasa; Ernesto Quesada; Ana San-Félix Synthesis of Highly Condensed Polycyclic Carbohydrates by Reaction of a Spirocyclic Enamino Sulfonate Derived from D-Xylofuranose with Bifunctional Reagents Journal of Organic Chemistry, 2007, 72, 9713-9721 |
4023882 | CIF | C12 H15 N S | P b c a | 14.5885; 8.2099; 18.071 90; 90; 90 | 2164.3 | Tetsuharu Hori; Yuko Otani; Masatoshi Kawahata; Kentaro Yamaguchi; Tomohiko Ohwada Nonplanar Structures of Thioamides Derived from 7-Azabicyclo[2.2.1]heptane. Electronically Tunable Planarity of Thioamides Journal of Organic Chemistry, 2008, 73, 9102-9108 |
4036541 | CIF | C12 H15 N3 O4 | P 1 21/n 1 | 7.886; 16.68; 9.935 90; 102.028; 90 | 1278.1 | Miller, Ricarda; Carreras, Javier; Muratore, Michael E.; Gaydou, Morgane; Camponovo, Francesco; Echavarren, Antonio M. Broad Scope Aminocyclization of Enynes with Cationic JohnPhos-Gold(I) Complex as the Catalyst. The Journal of organic chemistry, 2016, 81, 1839-1849 |
4033306 | CIF | C12 H15 N3 S2 | C 1 c 1 | 11.4255; 11.8733; 9.826 90; 107.618; 90 | 1270.46 | Uzelac, Eric J.; McCausland, Casey B.; Rasmussen, Seth C. Pyrrolo[2,3-d:5,4-d']bisthiazoles: Alternate Synthetic Routes and a Comparative Study to Analogous Fused-Ring Bithiophenes. The Journal of organic chemistry, 2018, 83, 664-671 |
4031861 | CIF | C12 H15 N5 | P 1 21/c 1 | 5.991; 28.946; 7.1474 90; 111.95; 90 | 1149.6 | Motiwala, Hashim F.; Charaschanya, Manwika; Day, Victor W.; Aubé, Jeffrey Remodeling and Enhancing Schmidt Reaction Pathways in Hexafluoroisopropanol. The Journal of organic chemistry, 2016, 81, 1593-1609 |
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