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bin85666666

新虫 (小有名气)

[求助] 求助微谱数据查询 已有1人参与

本人化合物碳谱数据如下:
18.1,18.6,19.8,32.0,41.1,116.7,116.7,126.7,130.4
3Q!
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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
bin85666666: 金币+20 2014-05-07 14:09:03
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40个化合物(查询结果仅供参考)
1 .     3,4-dihydro-3,6,7-trimethyl-1H-quinoxalin-2-one
C11H14N2O     相似度:63.6%
Heterocycles          2006          68          1931-1939
Synthetic Studies of Bioactive Quinoxalinones: A Facile Approach to Potent Euglycemic and Hypolipidemic Agents
Sukanta Kamila and Edward R. Biehl*
Structure      13C NMR   碳谱模拟图
2 .     triphenyl(2,2,6,6-tetramethylcyclohexyloxy)silane
C28H34OSi     相似度:60%
Tetrahedron          2013          69          5609-5613
Chemoselective hydrosilylation of hydroxyketones
Marta L. Lage, Scott J. Bader, Kanicha Sa-ei, John Montgomery
Structure      13C NMR   碳谱模拟图
3 .     compound 15
    相似度:55.5%
Journal of Natural Products          1997          60          959-966
Isolation, Structure Elucidation, and Biological Activity of the Steroid Oligoglycosides and Polyhydroxysteroids from the Antarctic Starfish Acodontaster conspicuus
Simona De Marino, Maria Iorizzi, Franco Zollo, Luigi Minale, Charles D. Amsler, Bill J. Baker, and James B. McClintock
Structure      13C NMR   碳谱模拟图
4 .     3,4-dihydro-6-hydroxy-2(1H)-quinolinone
    相似度:55.5%
Natural Product Research          1993          3          227-231
Isolation of Quinolinones from Ayurvedic Processed Root Tubers of Aconitum ferox1
Jampani Bhogi Hanuman; Alfred Katz
Structure      13C NMR   碳谱模拟图
5 .     compound 3a
C11H18N4O2S     相似度:55.5%
Tetrahedron Letters          2000          41          8075-8078
One-pot synthesis of sulfamoylguanidines and sulfonylguanidines
Jing Zhang, Yan Shi
Structure      13C NMR   碳谱模拟图
6 .     5-isopropyl-1-aza-4-oxa-6-thiabicyclo[3.3.0]octane
C8H15NOS     相似度:55.5%
Canadian Journal of Chemistry          2004          82          268-278
Preparation and characterization of bicyclic amide acetals and monothioacetals
J Peter Guthrie, Roger T Gallant, Michael C Jennings
Structure      13C NMR   碳谱模拟图
7 .     compound 17
    相似度:55.5%
Canadian Journal of Chemistry          1976          54          917-925
13C nuclear magnetic resonance studies. 58. 13C spectra of a variety of bicyclo[2.2.2]octane derivatives. Further definition of the deshielding δ effect
J. B. Stothers, C. T. Tan
Structure      13C NMR   碳谱模拟图
8 .     r-2,t-3,t-5-trimethyltetrahydropyran
    相似度:55.5%
Organic Magnetic Resonance          1983          21          94-107
Carbon-13 NMR spectra of saturated heterocycles: XI—Tetrahydropyrans (oxanes)
Ernest L. Eliel, Muthiah Manoharan, K. Michal Pietrusiewicz and Karl D. Hargrave
Structure      13C NMR   碳谱模拟图
9 .     (3β,5α)-Cholesta-8(14),24-dien-3-ol
C27H44O     相似度:55.5%
Journal of the American Chemical Society          1989          111          278-284
Synthesis of zymosterol, fecosterol, and related biosynthetic sterol intermediates
Roland E. Dolle, Stanley J. Schmidt, Karl F. Erhard, Lawrence I. Kruse
Structure      13C NMR   碳谱模拟图
10 .     5-Hydroxy-1,2,3,4-tetrahydroisoquinoline Hydrochloride
C9H11NO     相似度:55.5%
Journal of Medicinal Chemistry          1987          30          2208-2216
Inhibition of phenylethanolamine N-methyltransferase (PNMT) by aromatic hydroxy-substituted 1,2,3,4-tetrahydroisoquinolines. Further studies on the hydrophilic pocket of the aromatic ring binding region of the active site
Daniel J. Sall, Gary L. Grunewald
Structure      13C NMR   碳谱模拟图
11 .     甲基苯酚
C7H8O     相似度:55.5%
Chinese Journal of Antibiotics          2011          36          576-580
Antibacterial metabolites from the endophytic fungus R7 of Aquilaria sinensis
Wei, Jing, Dai, Hao-Fu, Yu, Lei, Wang, Hui, and, Mei, Wen-Li
Structure      13C NMR   碳谱模拟图
12 .     3-[5-(Bromomethyl)-4-nitro-1H-imidazol-1-yl]propanenitrile
C7H7BrN4O2     相似度:55.5%
Tetrahedron          2013          69          9130-9138
Synthesis of substituted 5-bromomethyl-4-nitroimidazoles and use for the preparation of the hypoxia-selective multikinase inhibitor SN29966
Guo-Liang Lu, Amir Ashoorzadeh, Robert F. Anderson, Adam V. Patterson, Jeff B. Smaill
Structure      13C NMR   碳谱模拟图
Domyallbesttohaveahappylife.
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