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[求助]
微谱结构查询求助
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| 有微谱资源的帮忙查个结构，多谢。溶剂 DMSO;碳谱数据：28.69,28.69,59.15,106.17,119.88,124.00,129.87,130.95,139.78,154.22,165.31,166.66 |
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wangkaibo123
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【答案】应助回帖
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感谢参与，应助指数 +1
xxy885: 金币+5, ★★★★★最佳答案, 非常感谢，很有帮助！ 2013-07-02 09:26:49
感谢参与，应助指数 +1
xxy885: 金币+5, ★★★★★最佳答案, 非常感谢，很有帮助！ 2013-07-02 09:26:49
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按从小到大顺序输入，数字间用英文半角逗号(,)分隔例如： 21.4,30.4,37.4,73.2,73.7,125.6,126.6,139.6,140.2,168.2 28.69,28.69,59.15,106.17,119.88,124.00,129.87,130.95,139.78,154.22,165.31,166.66 溶剂选项： 全部 CDCl3 CD3CD2OD CD2Cl2 C5D5N C3D7NO CD3SOCD3 C4D8O (CH3)4Si C4D8O2 CD3COOD C4D8O2 H2O D2O CF3COOD CD3OD ND3 CD3COCD3 C6D6 CD3CN 查询空值 匹配容差： (数字格式，可自行设定) 相似度： %(相似度>=50%) 查询结果：共查到158个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . compound 3f C18H17N3O2 相似度:66.6% Heterocycles 2001 55 163-170 Fluorenyl Participated Ring Transformation of Urazoles to Triazinanediones Yong Gong,* Mark J. Bausch,* and Linhua Wang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . 4-nitroquinoline 1-oxide C10H8N2O4 相似度:66.6% Heterocycles 2001 55 1771-1778 One Pot Synthesis of Fused Pyrimidines from 2-[N-(Methylthiothiocarbonyl)amino]acetate A. Z. M. Shaifullah Chowdhury,* Yasuyuki Shibata, Masatoshi Morita, Kunimitsu Kaya, and Tomoharu Sano Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . cyclopiamide C16H14N2O2 相似度:60% Phytochemistry 1990 29 639-642 Cyclopiamide,an isoindolo[4,6-cd]indole from Penicillium cyclopium Cedric W. Holzapfel,Martin W. Bredenkamp,Renske M. Snyman,Jan C.A. Boeyens,Christine C. Allen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . NBBA 相似度:58.3% Magnetic Resonance in Chemistry 2002 40 219-224 Structural characterization of monomeric and oligomeric arylamides by solution and solid-state NMR spectroscopy Stefano Cavallaro, Giampietro Cum, Raffaele Gallo, Agatino Spadaro and Giuseppe Visalli Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . 2-Phenoxyterephthalic acid 相似度:58.3% Archiv der Pharmazie 1998 331 177-192 Substituted Xanthones as Antimycobacterial Agents,Part 1: Synthesis and Assignment of 1H/13C NMR Chemical Shifts Martina Pickert and Wilhelm Frahm Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . compound 3a C17H15N3O2 相似度:58.3% Heterocycles 2001 55 163-170 Fluorenyl Participated Ring Transformation of Urazoles to Triazinanediones Yong Gong,* Mark J. Bausch,* and Linhua Wang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . methyl 3-[(E)-3-ethoxyprop-2-enoylamino]benzoate C13H15NO4 相似度:58.3% Bioorganic & Medicinal Chemistry 2010 18 7132-7143 Synthesis and biological activities of new di- and trimeric quinoline derivatives Sidonie Broch, Hélène Hénon, Anne-Laure Debaud, Marie-Laure Fogeron, Nathalie Bonnefoy-Bérard, Fabrice Anizon, Pascale Moreau Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . 3-phenyl-7-trifluoromethyl[1,2,4]triazolo[4,3-a]pyrimidine C12H7F3N4 相似度:58.3% Journal of Heterocyclic Chemistry 2011 48 1085-1090 Regioselective synthesis and characterization of new 3-aryl-7-trifluoromethyl-[1,2,4]triazolo[4,3–a]pyrimidines Nilo Zanatta, Simone S. Amaral, Josiane M. dos Santos, Liana da S. Fernandes, Helio G. Bonacorso and Marcos A. P. Martins Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . 5,10-diphenyldithieno[3,2-b:3',2'-f][1,5]diazocine 相似度:58.3% Tetrahedron 2012 68 9665-9671 Trifluoroacetic acid catalyzed dibenzodiazocine synthesis: optimization and mechanism study Na Zhao, Li Qiu, Xiao Wang, Jianzhong Li, Yi Jiang, Xiaobo Wan Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . 3-amino-5-(3-methoxyphenyl)thiophene-2-carboxamide 相似度:58.3% Molecules 2013 18 4487-4509 Synthesis and Biological Evaluation of Thieno[3,2-d]- pyrimidinones, Thieno[3,2-d]pyrimidines and Quinazolinones: Conformationally Restricted 17b-Hydroxysteroid Dehydrogenase Type 2 (17b-HSD2) Inhibitors Enrico Perspicace, Sandrine Marchais-Oberwinkler and Rolf W. Hartmann Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . Ammosamide B C12H10ClN5O2 相似度:58.3% Angewandte Chemie International Edition 2009 48 725-727 The Ammosamides: Structures of Cell Cycle Modulators from a Marine-Derived Streptomyces Species Chambers C. Hughes, John B. MacMillan, Susana P. GaudÞncio, Paul R. Jensen, and William Fenical* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . 6-amino-3-methoxy-2-phenyl-4H-chromen-4-one C16H13NO3 相似度:57.1% Bioorganic & Medicinal Chemistry 2010 18 6012-6023 Anti-HIV and antiplasmodial activity of original flavonoid derivatives Gilles Casano, Aurélien Dumètre, Christophe Pannecouque, Sébastien Hutter, Nadine Azas, Maxime Robin Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . 6-aryl-3-(3-hydroxypropyl)-7H-1,2,4-triazolo[3,4-b][1,3,4] thiadiazine 2d C13H12F2N4OS 相似度:53.8% Molecules 2007 12 297-303 Syntheses and Biological Activities of 6-Aryl-3-(3-hydroxy- propyl)-7H-1, 2, 4-triazolo[3, 4-b][1, 3, 4]thiadiazines Jian-yu Jin, Li-xue Zhang, Xian-xing Chen, An-jiang Zhang and Hai-le Zhang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . N-(3-Chlorophenyl)-N'-phenylmalonamide C15H13ClN2O2 相似度:53.8% Molecules 2008 13 2442-2461 Design and Synthesis of Bis-amide and Hydrazide-containing Derivatives of Malonic Acid as Potential HIV-1 Integrase Inhibitors Mario Sechi, Ugo Azzena, Maria Paola Delussu, Roberto Dallocchio, Alessandro Dessì, Alessia Cosseddu, Nicolino Pala and Nouri Neamati Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . 6-phenyl-4-(2-methoxybenzylthio)-1,3,5-triazin-2(3H)-one C17H15N3O2S 相似度:53.8% Heterocycles 2010 81 91-115 The Synthesis of Novel 2,4,6-Trisubstituted 1,3,5-Triazines: A Search for Potential MurF Enzyme Inhibitors Izidor Sosič, Bogdan Štefane, Andreja Kovač, Samo Turk, Didier Blanot, and Stanislav Gobec Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . (Z)-3-(1-benzylidene)phthalide 相似度:53.8% Heterocycles 2007 74 819-825 Theoretical Studies of 5-exo Selective Intramolecular Cyclization of O-Alkynylbenzoic Acid Catalyzed by Organic Base Masahiro Terada, Chikashi Kanazawa, and Masahiro Yamanaka Structure 13C NMR 碳谱模拟图 |
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