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柳林一路行木虫 (小有名气)
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[求助]
微谱求助。
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13C NMR (100 MHz, CDCl3) δ 168.91, 168.21, 167.51, 166.94, 145.82, 134.96, 134.90, 134.47, 131.88, 129.70, 129.23, 128.97, 128.94, 128.06, 127.74, 127.56, 124.90, 124.24, 124.13, 120.76, 119.78, 118.98, 118.63, 110.26, 109.27, 83.18, 63.71, 59.06, 57.36, 56.23, 56.17, 54.15, 40.13, 39.96, 38.91, 29.67, 29.45. 另外，63.71可能是杂质峰。 |
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wangkaibo123
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2楼2013-09-02 17:55:45
柳林一路行
木虫 (小有名气)
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3楼2013-09-02 19:23:35
笑多会怀孕
铁杆木虫 (著名写手)
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【答案】应助回帖
感谢参与，应助指数 +1
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查询结果：共查到51个化合物(查询结果仅供参考) 1 . compound IIIa C40H36N2O10 相似度:59.4% Russian Journal of Organic Chemistry 2002 38 982-994 Structure and Tautomerism of Cyclopentadiene Derivatives: IX. Synthesis and Structure of Substituted N-Cyclopentadienyl Amidinium Ylides G. A. Dushenko, I. E. Mikhailov, G. Reck, B. Schulz and A. Zschunke, et al. Structure 13C NMR 碳谱模拟图 2 . pestalazine A C37H38N6O4 相似度:56.7% Journal of Natural Products 2008 71(11) 1861-1865 Pestalazines and Pestalamides, Bioactive Metabolites from the Plant Pathogenic Fungus Pestalotiopsis theae Gang Ding, Lihua Jiang, Liangdong Guo, Xulin Chen, Hua Zhang, and Yongsheng Che Structure 13C NMR 碳谱模拟图 3 . cis-N-[2-(3'',4''-dimethoxyphenyl)-9,10-dimethoxy-4-oxo-1-phenyl-3,4,6,7-tetrahydro-2H-pyrido[2,1-a]isoquinolin-3-yl]benzamide C36H34N2O6 相似度:56.7% Tetrahedron 2012 68 2864-2875 Synthesis of benzoindoloquinolizines via a Cu(I)-mediated C–N bond formation Rattana Worayuthakarn, Prattya Nealmongkol, Somsak Ruchirawat, Nopporn Thasana Structure 13C NMR 碳谱模拟图 4 . 1-benzyl 3-methyl 2-(isochroman-1-yl)malonate C20H20O5 相似度:56.7% European Journal of Organic Chemistry 2010 4460-4467 Dehydrogenative Functionalization of C(sp3)–H Bonds Adjacent to a Heteroatom Mediated by Oxoammonium Salts Heinrich Richter and Olga García Mancheño Structure 13C NMR 碳谱模拟图 5 . 1-hex-5-ynyl-5-methoxy-3-phenylsulfanyl-1,3-dihydro-naphtho[2,3-c]thiophene 2,2-dioxide C25H27NO3S2 相似度:55.2% Heterocycles 2010 81 117-143 Exploration of Braverman Reaction Chemistry. Synthesis of Tricyclic Dihydrothiophene Dioxide Derivatives from Bispropargyl Sulfones Ken S. Feldman and Brandon R. Selfridge Structure 13C NMR 碳谱模拟图 6 . methyl 2-((1H-benzo[d][1,2,3]triazol-1-yl)(o-tolyl)-methyl)-3-oxobutanoate C19H19N3O3 相似度:55.2% Journal of Heterocyclic Chemistry 2011 48 434-440 Selective substitution reactions of methoxycarbonylamino-1-(1-benzotriazolyl)alkanes with active methylene compounds Liejin Zhou, Xin Lv, Hui Mao and Xiaoxia Wang Structure 13C NMR 碳谱模拟图 7 . asperazine C40H36N6O4 相似度:55% The Journal of Organic Chemistry 1997 62 7078-7079 Asperazine, a Selective Cytotoxic Alkaloid from a Sponge-Derived Culture of Aspergillus niger Mustafa Varoglu, Thomas H. Corbett, Frederick A. Valeriote, and Phillip Crews, Structure 13C NMR 碳谱模拟图 8 . (-)-antioquine C37H40N2O6 相似度:54.0% Phytochemistry 2000 54 709-716 Bisbenzylisoquinoline alkaloids from Guatteria boliviana (Annonaceae) Valérie Mahiou, François Roblot, Alain Fournet, Reynald Hocquemiller Structure 13C NMR 碳谱模拟图 9 . compound 12 相似度:54.0% Journal of Natural Products 1995 Vol 58 1570-1574 Triterpenoids from the Aerial Parts of Lantana camara Sabira Begum, Syed Mohammad Raza, Bina Shaheen Siddiqui, Salimuzzaman Siddiqui Structure 13C NMR 碳谱模拟图 10 . N-(4-Aminophthalimidohexyl)-25,27-(diamidomonoazacrown-5)-calix[4]arene C54H55N5O8 相似度:54.0% Chinese Chemical Letters 2010 21 807-809 Novel synthesis of N-substituted-calix[4]azacrown derivatives Zhi Qiang Shi; Ya Qing Feng; Shu Xian Meng Structure 13C NMR 碳谱模拟图 11 . (3S,6S)-1-(o-azidobenzoyl)-4-(2'',4''-dimethoxybenzyl)-3-[1'(o-azidobenzoyl)-3'-indolylmethyl]-6-methyl-2,5-piperazinedione C37H31N9O6 相似度:54.0% Heterocycles 2000 53 1765-1782 Synthesis of a Seco Analogue of Ardeemin Esmeralda Caballero, Carmen Avendaño,* and J. Carlos Menéndez* Structure 13C NMR 碳谱模拟图 |
4楼2013-09-02 20:16:48
wangkaibo123
荣誉版主 (职业作家)
kerry
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专家经验: +726 - PhEPI: 3
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【答案】应助回帖
★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
柳林一路行: 金币+30, ★★★★★最佳答案, xx 2013-09-02 20:24:11
柳林一路行: 金币+30, ★★★★★最佳答案, xx 2013-09-02 20:24:11
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查询模式：模糊查询 碳谱数据输入： 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 溶剂选项： 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51个化合物(查询结果仅供参考) 1 . compound IIIa C40H36N2O10 相似度:59.4% Russian Journal of Organic Chemistry 2002 38 982-994 Structure and Tautomerism of Cyclopentadiene Derivatives: IX. Synthesis and Structure of Substituted N-Cyclopentadienyl Amidinium Ylides G. A. Dushenko, I. E. Mikhailov, G. Reck, B. Schulz and A. Zschunke, et al. Structure 13C NMR 碳谱模拟图 2 . pestalazine A C37H38N6O4 相似度:56.7% Journal of Natural Products 2008 71(11) 1861-1865 Pestalazines and Pestalamides, Bioactive Metabolites from the Plant Pathogenic Fungus Pestalotiopsis theae Gang Ding, Lihua Jiang, Liangdong Guo, Xulin Chen, Hua Zhang, and Yongsheng Che Structure 13C NMR 碳谱模拟图 3 . cis-N-[2-(3'',4''-dimethoxyphenyl)-9,10-dimethoxy-4-oxo-1-phenyl-3,4,6,7-tetrahydro-2H-pyrido[2,1-a]isoquinolin-3-yl]benzamide C36H34N2O6 相似度:56.7% Tetrahedron 2012 68 2864-2875 Synthesis of benzoindoloquinolizines via a Cu(I)-mediated C–N bond formation Rattana Worayuthakarn, Prattya Nealmongkol, Somsak Ruchirawat, Nopporn Thasana Structure 13C NMR 碳谱模拟图 4 . 1-benzyl 3-methyl 2-(isochroman-1-yl)malonate C20H20O5 相似度:56.7% European Journal of Organic Chemistry 2010 4460-4467 Dehydrogenative Functionalization of C(sp3)–H Bonds Adjacent to a Heteroatom Mediated by Oxoammonium Salts Heinrich Richter and Olga García Mancheño Structure 13C NMR 碳谱模拟图 5 . 1-hex-5-ynyl-5-methoxy-3-phenylsulfanyl-1,3-dihydro-naphtho[2,3-c]thiophene 2,2-dioxide C25H27NO3S2 相似度:55.2% Heterocycles 2010 81 117-143 Exploration of Braverman Reaction Chemistry. Synthesis of Tricyclic Dihydrothiophene Dioxide Derivatives from Bispropargyl Sulfones Ken S. Feldman and Brandon R. Selfridge Structure 13C NMR 碳谱模拟图 6 . methyl 2-((1H-benzo[d][1,2,3]triazol-1-yl)(o-tolyl)-methyl)-3-oxobutanoate C19H19N3O3 相似度:55.2% Journal of Heterocyclic Chemistry 2011 48 434-440 Selective substitution reactions of methoxycarbonylamino-1-(1-benzotriazolyl)alkanes with active methylene compounds Liejin Zhou, Xin Lv, Hui Mao and Xiaoxia Wang Structure 13C NMR 碳谱模拟图 7 . asperazine C40H36N6O4 相似度:55% The Journal of Organic Chemistry 1997 62 7078-7079 Asperazine, a Selective Cytotoxic Alkaloid from a Sponge-Derived Culture of Aspergillus niger Mustafa Varoglu, Thomas H. Corbett, Frederick A. Valeriote, and Phillip Crews, Structure 13C NMR 碳谱模拟图 8 . (-)-antioquine C37H40N2O6 相似度:54.0% Phytochemistry 2000 54 709-716 Bisbenzylisoquinoline alkaloids from Guatteria boliviana (Annonaceae) Valérie Mahiou, François Roblot, Alain Fournet, Reynald Hocquemiller Structure 13C NMR 碳谱模拟图 9 . compound 12 相似度:54.0% Journal of Natural Products 1995 Vol 58 1570-1574 Triterpenoids from the Aerial Parts of Lantana camara Sabira Begum, Syed Mohammad Raza, Bina Shaheen Siddiqui, Salimuzzaman Siddiqui Structure 13C NMR 碳谱模拟图 10 . N-(4-Aminophthalimidohexyl)-25,27-(diamidomonoazacrown-5)-calix[4]arene C54H55N5O8 相似度:54.0% Chinese Chemical Letters 2010 21 807-809 Novel synthesis of N-substituted-calix[4]azacrown derivatives Zhi Qiang Shi; Ya Qing Feng; Shu Xian Meng Structure 13C NMR 碳谱模拟图 11 . (3S,6S)-1-(o-azidobenzoyl)-4-(2'',4''-dimethoxybenzyl)-3-[1'(o-azidobenzoyl)-3'-indolylmethyl]-6-methyl-2,5-piperazinedione C37H31N9O6 相似度:54.0% Heterocycles 2000 53 1765-1782 Synthesis of a Seco Analogue of Ardeemin Esmeralda Caballero, Carmen Avendaño,* and J. Carlos Menéndez* Structure 13C NMR 碳谱模拟图 12 . N-(4'-amino-3,3'-dimethoxybiphenyl-4-yl)-2-(1,3-dioxo-6-(2-(phenylthio)ethylamino)-1H-benzo[de]isoquinolin-2(3H)-yl)-4-methylpentanamide C40H40N4O5S 相似度:54.0% Bioorganic & Medicinal Chemistry 2009 17 592-599 Novel naphthalimide–amino acid conjugates with flexible leucine moiety as side chain: Design, synthesis and potential antitumor activity Aibin Wu, Yufang Xu, Xuhong Qian Structure 13C NMR 碳谱模拟图 13 . methyl 2-((1H-benzo[d][1,2,3]triazol-1-yl)(m-tolyl)-methyl)-3-oxobutanoate C19H19N3O3 相似度:54.0% Journal of Heterocyclic Chemistry 2011 48 434-440 Selective substitution reactions of methoxycarbonylamino-1-(1-benzotriazolyl)alkanes with active methylene compounds Liejin Zhou, Xin Lv, Hui Mao and Xiaoxia Wang Structure 13C NMR 碳谱模拟图 14 . 17-(Indol-3-yl)-19-phenyl-10,16,17,17a-tetrahydro[1,5]benzodiazepino[2',3':2,3] [1,4] benzodiazepino[5,4-b][1,3,5]benzotriazepine C37H26N7 相似度:54.0% Journal of Heterocyclic Chemistry 2012 49 173-182 A facile synthesis of 2-alkyl-3-α-carboxy-α-styryl/heterylvinyl quinazolin-4(3H)-ones and 3-arylidene/heterylmethylidene-4-aroyl-1H-[1,4]benzodiazepine-2,5(3H,4H)-diones and their transformation into novel heterocyclyl and heterocyclo analogues Poonam Gupta, Archana Sharma and R. L. Sharma Structure 13C NMR 碳谱模拟图 15 . (2S,10S,10aS)-9-allyloxy-10-benzoyloxy-1,2,3,5,10,10a-hexahydropyrrolo[1,2-b]isoquinolin-2-yl (2'S,3'R)-3'-benzoylamino-2'-hydroxy-3'-(2-(but-3-enyloxy)phenyl)-propanoate C42H42N2O8 相似度:53.8% Bioorganic & Medicinal Chemistry 2011 19 7664-7678 Design and synthesis of simplified taxol analogs based on the T-Taxol bioactive conformation Jielu Zhao, Susan Bane, James P. Snyder, Haipeng Hu, Kamalika Mukherjee, Carla Slebodnick, David G.I. Kingston Structure 13C NMR 碳谱模拟图 16 . 4-tert-butyl 1-methyl (2R*,3S*)-2-hydroxy-3-(naphthalen-1-yl-amino)-2-[(E)-2-phenylethenyl]butanedioate and 4-tert-butyl 1-methyl (2R*,3R*)-2-hydroxy-3-(naphthalen-1-ylamino)-2-[(E)-2-phenylethenyl]butanedioate C27H29NO5 相似度:52.3% European Journal of Organic Chemistry 2011 1113-1124 Highly Regioselective, Three-Component Reactions of Diazoacetates with Anilines and β,-Unsaturated -Keto Esters: 1,2-Addition versus 1,4-Addition Yingguang Zhu, Changwei Zhai, Liping Yang and Wenhao Hu Structure 13C NMR 碳谱模拟图 |
5楼2013-09-02 20:17:59
