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yypncu捐助贵宾 (小有名气)
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[求助]
求助微谱数据
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求助微谱，有三个化合物，本人金币实在有限，望好心人帮忙，非常感谢！ 化合物1，溶剂重水，碳谱数据：10.34,12.21,15.63,80.36,133.42,152.87,176.21 化合物2，溶剂重水，碳谱数据：26.31,27.14,29.73,39.22,41.95,43.75,50.84,52.97,66.35,173.59,177.19,181.27 化合物3，溶剂重水，碳谱数据：8.51,24.97,35.54,36.57,36.69,39.84,60.87,61.76,63.41,63.57,70.17,71.37,72.14,90.69,112.67,112.69,120.71,120.89,148.56,148.65,151.58,191.49,191.82 最后再次感谢！ |
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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
感谢参与，应助指数 +1
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一次只能求一个 一个20金币 谢谢 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4个化合物(查询结果仅供参考) 1 . 2-formyl-5-iodo-4-methyl-3-ethyl-1H-pyrrole 相似度:57.1% Journal of Heterocyclic Chemistry 2003 40 707-712 A novel diacetylenic bilirubin Bilirubin Bin Tu and David A. Lightner Structure 13C NMR 碳谱模拟图 2 . 5,6-Dimethyl-2-selenoxo-1,2-dihydrothieno[2,3-d]pyrimidine-4-one C8H8N2OSSe 相似度:50% Molecules 2000 5 37-50 Acid-Base Initiated Cyclization and Retrocyclization Reactions of Ethyl 2-(3-Acylselenoureido)benzoates, -thiophene-3-carboxylates and the Corresponding 2-(3-Acylisoselenoureido) Derivatives Jiri Sibor, Dalimil Zurek, Otakar Humpa and Pavel Pazdera Structure 13C NMR 碳谱模拟图 3 . 3-[Diisopropyl(hydroxy)silyl]-5-methyl-2(5H)-furanone C11H20O3Si 相似度:50% Zeitschrift für Naturforschung B 2004 59 1444-1450 Intramolecular Carbene and Carbenoid Reactions of a-(Vinyloxy)silyl-a-diazoacetates B. Daucher, V. Gettwert, R. Striegler, and G. Maas Structure 13C NMR 碳谱模拟图 4 . 4-amino-5,6-dimethylthieno[2,3-d]pyrimidine-2-(1H)-selone C8H9N3SSe 相似度:50% Collection of Czechoslovak Chemical Communications 1999 64 1673-1695 2-(3-Acylselenoureido)benzonitriles and 2-(3-Acylselenoureido)thiophene-3-carbonitriles. Preparation, Structure Elucidation, Cyclization and Retrocyclization Reactions Jiří Šibor, Dalimil Žůrek, Radek Marek, Michal Kuty, Otakar Humpa, Jaromír Marek and Pavel Pazdera* Structure 13C NMR 碳谱模拟图 |
2楼2013-11-24 21:15:47
yypncu
捐助贵宾 (小有名气)
- 应助: 5 (幼儿园)
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- 虫号: 1784584
- 注册: 2012-04-28
- 性别: GG
- 专业: 天然药物化学
3楼2013-11-25 10:16:59
wangkaibo123
荣誉版主 (职业作家)
kerry
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专家经验: +726 - PhEPI: 3
- 应助: 1928 (讲师)
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【答案】应助回帖
★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
yypncu: 金币+20, ★★★★★最佳答案, thank you 2013-11-25 12:51:15
yypncu: 金币+20, ★★★★★最佳答案, thank you 2013-11-25 12:51:15
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2 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142个化合物(查询结果仅供参考) 1 . 5,5-Dimethyl-9-oxodecansaure-methylester C13H24O3 相似度:58.3% Helvetica Chimica Acta 1980 63 1833-1855 Photochemische Reaktionen 111. Mitteilung [1] Zur Photochemie , -ungesättigter , -Epoxyester I: Singulett- versus Triplettreaktivität Alex Peter Alder, Hans Richard Wolf, Oskar Jeger Structure 13C NMR 碳谱模拟图 2 . (N2-(2'S')-Bis(1',4'-methoxycarbonyl)propyl,N5-tert-butyloxycarbonyl)-1,2,5-thiadiazolidine-1,1-dioxide C14H24 N2O8S 相似度:58.3% Molecules 2005 10 1387-1398 N, N’-Substituted 1, 2, 5 Thiadiazolidine 1, 1-Dioxides: Synthesis, Selected Chemical and Spectral Proprieties and Antimicrobial Evaluation A. Bendjeddou, R. Djeribi, Z. Regainia and N. Aouf Structure 13C NMR 碳谱模拟图 3 . 4,10-diacetate of 4-oxo-cis-myrtanol 相似度:58.3% Phytochemistry 1997 45 935-943 Biotransformation of (−  -cis-myrtanol and (+)-trans-myrtanol by plant pathogenic fungus, Glomerella cingulataMitsuo Miyazawa, Yasuhiro Suzuki, Hiromu Kameoka Structure 13C NMR 碳谱模拟图 4 . methyl (±)-2-oxo-1-(3-oxopropyl)cycloheptanecarboxylate C12H18O4 相似度:58.3% Journal of Heterocyclic Chemistry 2003 40 113-120 N-phenyl-substituted pyrrolidines,piperidines and azabicyclics by a tandem reduction-double reductive amination reaction Richard A. Bunce,Derrick M. Herron,Jason R. Lewis and Sharadsrikar V. Kotturi Structure 13C NMR 碳谱模拟图 5 . trans-4-(2-Hydroxy-1-methylethyl) cyclohexanecarboxylic acid methyl ester C11H20O3 相似度:58.3% Bioorganic & Medicinal Chemistry 1996 4 1771-1781 Structure determination of metabolites isolated from urine and bile after administration of AY4166, a novel d-phenylalanine-derivative hypoglycemic agent Hiroko Takesada, Keizo Matsuda, Ryoko Ohtake, Ryuichi Mihara, Ichiro Ono, Kenzo Tanaka, Masaki Naito, Masanobu Yatagai, Ei-ichiro Suzuki Structure 13C NMR 碳谱模拟图 6 . Methyl 2-(3-methoxycarbonylethyl)azetidine-2-carboxylate 相似度:58.3% Tetrahedron 2012 68 4117-4128 Synthesis of spirocyclopropyl γ-lactams by tandem intramolecular azetidine ring-opening/closing cascade reaction: synthetic and mechanistic aspects Pierre-Antoine Nocquet, Damien Hazelard, Philippe Compain Structure 13C NMR 碳谱模拟图 7 . Methyl 8-(Dimethoxyphosphoryl)-7-oxooctanoate 相似度:58.3% European Journal of Organic Chemistry 2012 2621-2634 Total Synthesis of Isoprostanes Derived from Adrenic Acid and EPA Camille Oger, Valérie Bultel-Poncé, Alexandre Guy, Thierry Durand and Jean-Marie Galano Structure 13C NMR 碳谱模拟图 8 . N-(N′-tert-butoxycarbonyl-L-alanyl)-1,6-diaminohexane 相似度:58.3% molecules 2011 16 4695-4718 The 2-(Triphenylsilyl)ethoxycarbonyl-(“Tpseoc”-) Group: A New Silicon-Based, Fluoride Cleavable Oxycarbonyl Protecting Group Highly Orthogonal to the Boc-, Fmoc-and Cbz-Groups Martin Golkowski and Thomas Ziegler Structure 13C NMR 碳谱模拟图 9 . (1R,2R,5R)-3-[(2-aminoethyl)imino]-2,6,6-trimethylbicyclo[3.1.1]heptan-2-ol 相似度:58.3% Russian Journal of Organic Chemistry 2011 47 1130-1138 Synthesis of 1,2-diamine ligands based on natural monoterpenoids I. A. Dvornikova, E. V. Buravlev, L. L. Frolova, Yu. V. Nelyubina and I. Yu. Chukicheva, et al. Structure 13C NMR 碳谱模拟图 10 . (-)-6α-hydroxy-β-pinene C10H16O 相似度:58.3% Zeitschrift für Naturforschung C 2002 57 686-690 The Microbial Oxidation of (-)-b-Pinene by Botrytis cinerea A. Farooq, M., I. Choudhary, S. Tahara, Atta-ur-Rahman, K. H. C. Ba\cser, and F. Demirci Structure 13C NMR 碳谱模拟图 11 . compound 31 相似度:58.3% Organic Magnetic Resonance 1983 21 Carbon-13 NMR spectra and the method for their calculation for long-chain polybranched carboxylic acids and their derivatives V. I. Dostovalova, A. B. Terent'ev, N. S. Ikonnikov and R. Kh. Freidlina Structure 13C NMR 碳谱模拟图 12 . (±)-cis-1-[(tert-butyloxycarbonyl)amino]cyclopentane-1,3-dicarboxylic acid dimethyl ester 相似度:58.3% The Journal of Peptide Research 1997 49 28-45 Vitamin K-dependent carboxylase : In vitro inhibitory activity of cyclopentane and cyclohexane-derived analogues of glutamic acid and their conformational study by NMR and molecular dynamics in aqueous solution VALéRY LARUE, JOSYANE GHARBI-BENAROUS, FRANCINE ACHER, ROBERT AZERAD and JEAN-PIERRE GIRAULT Structure 13C NMR 碳谱模拟图 13 . mycenarubin A 相似度:57.1% Journal of Natural Products 2007 70 1274-1277 Sanguinones A and B, Blue Pyrroloquinoline Alkaloids from the Fruiting Bodies of the Mushroom Mycena sanguinolenta Silke Peters and Peter Spiteller Structure 13C NMR 碳谱模拟图 14 . mycenarubin A C14H16N4O3 相似度:57.1% European Journal of Organic Chemistry 2008 2008 319-323 Red Pyrroloquinoline Alkaloids from the Mushroom Mycena haematopus Silke Peters, Robert J. R. Jaeger and Peter Spiteller Structure 13C NMR 碳谱模拟图 15 . mycenarubin A C14H16N3O4 相似度:57.1% European Journal of Organic Chemistry 2007 2007 1571-1576 Mycenarubins A and B, Red Pyrroloquinoline Alkaloids from the Mushroom Mycena rosea Silke Peters and Peter Spiteller Structure 13C NMR 碳谱模拟图 16 . tanarifuranonol C13H22O3 相似度:53.8% Journal of Natural Products 2005 68 927-930 Constituents of the Leaves of Macaranga tanarius Suporn Phommart, Pakawadee Sutthivaiyakit, Nitirat Chimnoi, Somsak Ruchirawat, and Somyote Sutthivaiyakit Structure 13C NMR 碳谱模拟图 17 . cis-10,10-dimethyltricyclo[7.1.1.0(2.7)]undec-2-en-4-one 相似度:53.8% Helvetica Chimica Acta 1981 64 113-152 Anil-Synthese. 23. Mitteilung. über die Herstellung von Styryl- und Stilbenyl-Derivaten des Pyrimidins Kurt Burdeska, Hermann Fuhrer, Guglielmo Kabas, Adolf Emil Siegrist Structure 13C NMR 碳谱模拟图 18 . Ethyl-6-(2,5-dioxopyrrolidin-1-yl)-2-(2-oxopyrrolidin-1-yl)hexanoate C16H24O5N2 相似度:53.8% Molecules 2009 14 3019-3029 Coupling Reactions of α-Bromocarboxylate with Non-Aromatic N-Heterocycles Katerina Brychtova, Barbora Slaba, Lukas Placek, Josef Jampilek, Ivan Raich and Jozef Csollei Structure 13C NMR 碳谱模拟图 19 . Ethyl-6-(2,5-dioxopyrrolidin-1-yl)-2-(4-oxopiperidin-1-yl)hexanoate C17H26O5N2 相似度:53.8% Molecules 2009 14 3019-3029 Coupling Reactions of α-Bromocarboxylate with Non-Aromatic N-Heterocycles Katerina Brychtova, Barbora Slaba, Lukas Placek, Josef Jampilek, Ivan Raich and Jozef Csollei Structure 13C NMR 碳谱模拟图 |
4楼2013-11-25 10:31:13
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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- 管辖: 药学
5楼2013-11-25 10:33:47
10