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20001214金虫 (初入文坛)
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[求助]
求微谱，哪位大神帮个忙？ 已有1人参与
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碳谱数据： 144.9， 140.5， 128.8， 128.3， 127.9， 126.3， 125.8， 123.6， 75.0， 74.8， 68.2， 68.2， 29.1， 28.8， 15.8 |
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风行者007
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【答案】应助回帖
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20001214: 金币+10, ★★★★★最佳答案 2014-06-13 23:42:04
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20001214: 金币+10, ★★★★★最佳答案 2014-06-13 23:42:04
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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407个化合物(查询结果仅供参考) 1 . 2-(4-biphenylyl)-4-(4-ethylphenyl)-1H-imidazole C23H20N2 相似度:66.6% Heterocycles 2005 65 1975-1984 Synthesis of 2,4-Diarylimidazoles through Suzuki Cross-coupling Reactions of Imidazole Halides with Arylboronic Acids Ingo Langhammer and Thomas Erker* Structure 13C NMR 碳谱模拟图 2 . 5-methyl-5-phenyl-3-(3-phenyl-propyl)-4,5-dihydroisoxazole C19H21NO 相似度:66.6% Bioorganic & Medicinal Chemistry 2010 18 3437-3447 Synthesis and biological evaluation of phenolic 4, 5-dihydroisoxazoles and 3-hydroxy ketones as estrogen receptor α and β agonists Pekka K. Poutiainen, Tuomas A. Venäläinen, Mikael Peräkylä, Juha M. Matilainen, Sami Väisänen, Paavo Honkakoski, Reino Laatikainen, Juha T. Pulkkinen Structure 13C NMR 碳谱模拟图 3 . benzyloxy-(2,2-dimethyl-[1,3]dioxolan-4-yl)-acetic acidmethyl ester C15H20O5 相似度:66.6% Tetrahedron 2013 69 2157-2166 Stereoselective total synthesis of both (6R,9R,10S,7E)- and (6S,9R,10S,7E)-epimers of oxylipin (9R,10S,7E)-6,9,10-trihydroxyoctadec-7-enoic acid Bishwajit Saikia, Thongam Joymati Devi, Nabin C. Barua Structure 13C NMR 碳谱模拟图 4 . 3-Hydroxy-2-methyl-3-(4-biphenylyl)butanoic acid C17H18O3 相似度:60% Molecules 2008 13 603-615 Docking Studies and Anti-inflammatory Activity of β-Hydroxy-β-arylpropanoic Acids Sanda P. Dilber, Silva L. Dobric, Zorica D. Juranic, Bojan D. Markovic, Sote M. Vladimirov and Ivan O. Juranic Structure 13C NMR 碳谱模拟图 5 . 1-(4'-Ferrocenyl)benzoyl-2-phenylcyclopropane C26H22FeO 相似度:60% Canadian Journal of Chemistry 2005 83 2140-2143 A rapid, microwave-assisted, one-pot cyclopropanation reaction to synthesize (4-ferrocenyl)benzoylcyclopropane in the solid state Juxing Yin, Xiaolong Li, Xiaoli Wu, Baohua Chen, Zenglu Liu, and Qingbao Song Structure 13C NMR 碳谱模拟图 6 . N-[4-(2-fluoro-5-nitrophenyl)-butyl]benzylamine C17H19FN2O2 相似度:60% Journal of Heterocyclic Chemistry 2008 45 551-557 Benzo-fused heterocycles and carbocycles by intramolecular SNAr and tandem SN2-SNAr reactions Richard A. Bunce,Takahiro Nago,Nathan Sonobe and Legrande M. Slaughter Structure 13C NMR 碳谱模拟图 7 . 2,6-diethyl-3-methylquinoline C14H17N 相似度:60% Journal of Heterocyclic Chemistry 2000 37 1315-1320 Ruthenium-Catalyzed synthesis of quinolines from anilines and N-allylic compounds by cascade amine exchange reaction-heteroannulation Chan Sik Cho, Byoung Ho Oh, Sang Chul Shim and Dae Hee Oh Structure 13C NMR 碳谱模拟图 8 . compound 3b C15H16Cl2O3 相似度:60% Tetrahedron Letters 2005 46 8885-8888 Novel protocol for the generation of β-branched Baylis-Hillman adducts from ethyl sorbate and aryl aldehydes Palakodety Radha Krishna, M. Narsingam, P. Srinivas Reddy, G. Srinivasulu, A.C. Kunwar Structure 13C NMR 碳谱模拟图 9 . 1-(3-乙基苯基)-1,2-乙二醇 相似度:60% Journal of Shenyang Pharmaceutical University 2006 23 274-276 Studies on the constituents from the stems of Opuntia dillenii QIU Ying-kun, DOU De-qiang, XU Bi-xia, PEI Yu-ping Structure 13C NMR 碳谱模拟图 10 . 3-Phenethyl-benzothiophene-2-carbaldehyde C17H14OS 相似度:60% Archiv der Pharmazie 1997 330 107-108 New Benzothiophene Compounds Related to Propafenone Bernard Unterhalt and Lucas Rems Structure 13C NMR 碳谱模拟图 11 . compound 5i C20H19F3 相似度:60% European Journal of Organic Chemistry 2012 2643-2655 A Joint Experimental and Computational Investigation on Homoconjugated Push-Pull Chromophores Derived from 7,7-Diphenylnorbornane Noelia Herrero-García, María del Rosario Colorado Heras, María del Rosario Torres, Israel Fernández and José Osío Barcina Structure 13C NMR 碳谱模拟图 12 . 5-methyl-3-phenethyl-5-phenyl-4,5-dihydroisoxazole C18H19NO 相似度:60% Bioorganic & Medicinal Chemistry 2010 18 3437-3447 Synthesis and biological evaluation of phenolic 4, 5-dihydroisoxazoles and 3-hydroxy ketones as estrogen receptor α and β agonists Pekka K. Poutiainen, Tuomas A. Venäläinen, Mikael Peräkylä, Juha M. Matilainen, Sami Väisänen, Paavo Honkakoski, Reino Laatikainen, Juha T. Pulkkinen Structure 13C NMR 碳谱模拟图 13 . indan-1-one N-phenylthiosemicarbazone C16H15N3S 相似度:60% Bioorganic & Medicinal Chemistry 2011 19 6818-6826 Thiosemicarbazones derived from 1-indanones as new anti-Trypanosoma cruzi agents María E. Caputto, Lucas E. Fabian, Diego Benítez, Alicia Merlino, Natalia Ríos, Hugo Cerecetto, Graciela Y. Moltrasio, Albertina G. Moglioni, Mercedes González, Liliana M. Finkielsztein Structure 13C NMR 碳谱模拟图 14 . (1E,3E)-1,4-bis(4-tert-butoxycarbonyl-1-naphthyl)-2,3-dinitro-1,3-butadiene C34H32N2O8 相似度:60% Bioorganic & Medicinal Chemistry 2008 16 240-247 Design, synthesis, and in vitro evaluation of new naphthylnitrobutadienes with potential antiproliferative activity: Toward a structure/activity correlation Giovanni Petrillo, Maria A. Mariggiò, Cinzia Aiello, Cinzia Cordazzo, Carla Fenoglio, Stefano Morganti, Michela Croce, Egon Rizzato, Domenico Spinelli, Massimo Maccagno, Lara Bianchi, Claudia Prevosto, Cinzia Tavani, Maurizio Viale Structure 13C NMR 碳谱模拟图 15 . 4-methyl-N-(10-methyl-anthracen-9-ylmethylene)-benzenesulfonamide C23H19NO2S 相似度:60% Tetrahedron 2012 68 3283-3287 Synthesis of dizocilpine Meng-Yang Chang, Yu-Ping Huang, Tein-Wei Lee, Yeh-Long Chen Structure 13C NMR 碳谱模拟图 16 . 3-(4-ethylphenyl)-1-methyl-5-phenyl-4,5-dihydro-1H-pyrazol C18H20N2 相似度:60% European Journal of Organic Chemistry 2011 4919-4924 A Straightforward Synthesis of Pyrazolines and Pyrazoles: Palladium-Catalyzed Carbonylative Vinylation–Cyclocondensation Reactions of Aryl Halides Xiao-Feng Wu, Helfried Neumann and Matthias Beller Structure 13C NMR 碳谱模拟图 17 . 2-ethyl-6-methylphenyl phenyl sulfide C15H16S 相似度:60% European Journal of Organic Chemistry 2011 1776-1781 An Efficient Copper-Catalyzed Cross-Coupling Reaction of Thiols with Aryl Iodides Hsin-Lun Kao, Chin-Keng Chen, Yu-Jen Wang and Chin-Fa Lee Structure 13C NMR 碳谱模拟图 18 . methyl 5-phenyl-N-(phenylsulfonyl)-2-(trifluoromethyl)norvalinate C18H18F3NO4S 相似度:60% European Journal of Organic Chemistry 2010 1587-1592 Synthesis of α-Alkynyl-β,β,β-trifluoroalanine Derivatives by Sonogashira Cross-Coupling Reaction Grigorii T. Shchetnikov, Maria A. Zotova, Christian Bruneau, Pierre H. Dixneuf and Sergey N. Osipov Structure 13C NMR 碳谱模拟图 19 . 2-[2,2-dimethyl-1-(4-trifluoromethylphenyl)propylidenamino]-2-phenylpropionamide C21H23F3N2O 相似度:60% European Journal of Organic Chemistry 2010 882-889 New Stable N-H Oxaziridines – Synthesis and Reactivity Sylvain Blanc, Céline A. C. Bordogna, Benjamin R. Buckley, Mark R. J. Elsegood and Philip C. Bulman Page Structure 13C NMR 碳谱模拟图 20 . 1-benzyl-1,2-dihydro-2,2,4-trimethylquinoline C19H21N 相似度:60% Journal of Medicinal Chemistry 2010 53 966-982 Antitrypanosomal Activity of 1,2-Dihydroquinolin-6-ols and Their Ester Derivatives Jean Fotie, Marcel Kaiser, Dawn A. Delfín, Joshua Manley, Carolyn S. Reid, Jean-Marc Paris, Tanja Wenzler, Louis Maes, Kiran V. Mahasenan, Chenglong Li and Karl A. Werbovetz Structure 13C NMR 碳谱模拟图 21 . 4-phenyl-7-ethyl-1,2,3,4-tetrahydronaphth-1-one oxime C18H19NO 相似度:60% Journal of Medicinal Chemistry 1994 37 3789-3811 5-Phenyl-3-ureidobenzazepin-2-ones as Cholecystokinin-B Receptor Antagonists John A. Lowe III, David L. Hageman, Susan E. Drozda, Stafford McLean, Dianne K. Bryce, Rosemary T. Crawford, Stevin Zorn, Jean Morrone, Jon Bordner Structure 13C NMR 碳谱模拟图 |
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