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[求助]
求微谱数据库，谢谢
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C谱数据如下： 7.730,7.774,12.741,13.617,14.103,20.667,29.323,29.653,31.662,35.940,48.187,49.721,50.222,50.690,55.907,72.151,95.803,98.052,115.234,127.179,127.763,127.836,127.971,128.049,128.103,128.880,129.330,129.526,130.424,130.474,130.572,131.150,140.388,147.563,148.742,149.438,152.443,157.152 氯仿溶解，谢谢 |
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3楼2012-08-08 00:31:17
【答案】应助回帖
★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与，应助指数 +1
304846814: 金币+15, ★★★很有帮助 2012-08-09 22:15:50
感谢参与，应助指数 +1
304846814: 金币+15, ★★★很有帮助 2012-08-09 22:15:50
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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 7.730,7.774,12.741,13.617,14.103,20.667,29.323,29.653,31.662,35.940,48.187,49.721,50.222,50.690,55.907,72.151,95.803,98.052,115.234,127.179,127.763,127.836,127.971,128.049,128.103,128.880,129.330,129.526,130.424,130.474,130.572,131.150,140.388,147.563,148.742,149.438,152.443,157.152 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11个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . lotusanine B C37H40N4O5 相似度:52.6% Journal of Natural Products 1995 Vol 58 504-511 New Cyclopeptide Alkaloids from Zizyphus lotus Musa Abu Zarga, Salim Sabri, Amal Al-Aboudi, M. Saleh Ajaz, Naheed Sultana, Atta-ur-Rahman Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . N1-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-N4-phenyl-N1-(2-phenylethyl)-N4-[1-(2-phenylethyl)-piperidin-4-yl]butanediamide C45H54N4O3 相似度:52.6% Helvetica Chimica Acta 2012 95 818-824 Designing and Synthesis of Novel Amidated Fentanyl Analogs (pages 818–824) Yaghoub Haghighatnia, Saeed Balalaie and Hamid Reza Bijanzadeh Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . 3-[1-(1-oxopropan-2-ylidene)-3-phenyl-1H-inden-2-yl]phenylmethanesulfonate C25H20O4S 相似度:50% Heterocycles 2010 80 1125-1147 Reaction Behavior of Cumulene: Diels–Alder, Friedel–Crafts, and Pd-Catalyzed Domino Reactions Tomohiro Asakawa, Mie Iinuma, Yuko Wakasugi, Mayumi Kuno, Takumi Furuta, Satoshi Fujii, Kiyoshi Tanaka, and Toshiyuki Kan Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . 3-benzyloxycarbonyl-1,2,3,4,5,6-hexahydro-3-benzazocine C16H23NO 相似度:50% Heterocycles 2009 77 575-585 8-Endo-Selective Aryl Radical Cyclization Leading to 3-Benzazocines Tsuyoshi Taniguchi, Hisaaki Zaimoku, and Hiroyuki Ishibashi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . 6-[(E)-2-(Dibutylamino)vinyl]-9-(2,3,5-tri-O-toluoyl-β-D-ribofuranosyl)purine C44H49N5O7 相似度:50% Bioorganic & Medicinal Chemistry 2008 16 1400-1424 Synthesis, cytostatic, and antiviral activity of novel 6-[2-(dialkylamino)ethyl]-, 6-(2-alkoxyethyl)-, 6-[2-(alkylsulfanyl)ethyl]-, and 6-[2-(dialkylamino)vinyl]purine nucleosides Martin Kuchař, Michal Hocek, Radek Pohl, Ivan Votruba, I-hung Shih, Eric Mabery, Richard Mackman Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . 5,7,3',4'-Tetra-O-benzyl-(+)-thiocatechin C43H38O5S 相似度:50% Molecules 2010 15 5595-5619 Enantioselctive Syntheses of Sulfur Analogues of Flavan-3-Ols Pradeep K. Sharma, Min He, Jurjus Jurayj, Da-Ming Gou, Richard Lombardy, Leo J. Romanczy, Jr. and Hagen Schroeter Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . E-1-{2-[(RS)-1-(4-Methoxyphenyl)-2-oxo-4-phenylazetidin-3-ylidene]propionyl}-1-valyl-1-proline benzyl ester C36H39N3O6 相似度:50% Pharmazie 2001 56 686-690 β-Lactam derivatives as enzyme inhibitors: Derivatives of (E)-2-[(RS)-1-(4-methoxyphenyl)-2-oxo-4-phenylazetidin-3-ylidene]propionic acid C. Venz - H.-H. Otto Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . 1-(((1-(3-(2-(7-Chloroquinolin-2-yl)ethenyl)-phenyl)-3-(3-iodo-5-(3-trifluoromethyl-3H-diazirin-3-yl)phenyl)propyl) thio)methyl)cyclopropaneacetic acid C34H28ClF3IN3O2S 相似度:50% Bioorganic & Medicinal Chemistry 1998 6 63-72 A novel photoaffinity probe for the LTD4 receptor Michel Gallant, Nicole Sawyer, Kathleen M. Metters, Robert J. Zamboni Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . yendolipin 相似度:50% Chemistry Letters 1994 23 2427-2430 A New Lipobetaine from the Red Alga Neodilsea yendoana Ryoichi Ishida, Yoshihide Matsuo, Minoru Suzuki, Atsushi Sato and Takeshi Matsumoto Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . yendolipin C48H78N2O5 相似度:50% Tetrahedron 1997 53 869-876 Yendolipin, a novel lipobetaine with an inhibitory activity toward morphogenesis in a foliaceous green alga Monostroma oxyspermum Yashihide Matsuo, Ryoichi Ishida, Takeshi Matsumoto, Masakazu Tatawaki, Minoru Suzuki Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . N1-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-N1,N4-diphenyl-N4-[1-(2-phenylethyl)piperidin-4-yl]butanediamide C43H50N4O3 相似度:50% Helvetica Chimica Acta 2012 95 818-824 Designing and Synthesis of Novel Amidated Fentanyl Analogs (pages 818–824) Yaghoub Haghighatnia, Saeed Balalaie and Hamid Reza Bijanzadeh Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- |
2楼2012-08-08 00:30:23
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