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试剂:氘代氯仿
C谱:7.94,11.25,25.73,29.91,32.27,45.65,56.75,122.34,126.79,129.07,131.09,132.65,139.28,145.07,147.43,160.18,173.47,179.89
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wangkaibo123

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kerry

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【答案】应助回帖

感谢参与,应助指数 +1
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112个化合物(查询结果仅供参考)
1 .     3'-(3-Bromophenyl)epibatidine
C17H17BrCl2N2     相似度:55.5%
Journal of Natural Products          2010          73          306-312
Synthesis, Nicotinic Acetylcholine Receptor Binding, and Antinociceptive Properties of 3′-(Substituted Phenyl)epibatidine Analogues. Nicotinic Partial Agonists
F. Ivy Carroll, Wei Ma, Liu Deng, Hernán A. Navarro, M. Imad Damaj and Billy R. Martin
Structure      13C NMR   碳谱模拟图
2 .     (1-Ethyl-6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)(phenyl)methanone
C21H25NO3     相似度:55.5%
Molecules          2011          16          7019-7042
Synthesis and Contractile Activity of Substituted 1, 2, 3, 4-Tetrahydroisoquinolines
Iliyan Ivanov, Stoyanka Nikolova, Dimo Aladjov, Iliyana Stefanova and Plamen Zagorchev
Structure      13C NMR   碳谱模拟图
3 .     (Z)-2-(4-fluorobenzylidene)-9-methyl-7-phenyl-5,6-dihydro-pyrazolo[3,4-f]thiazolo[2,3-b][1,3,5]triazepin-3-one
C21H16FN5OS     相似度:55.5%
Journal of Heterocyclic Chemistry          2009          46          756-761
An efficient two-step synthesis of novel thiazolo[2,3-b]pyrazolo[3,4-f][1,3,5]triazepines
Braulio Insuasty,Alexis Tigreros,Henry Martínez,Jairo Quiroga,Rodrigo Abonia,Alexander Gutierrez,Manuel Nogueras and Justo Cobo
Structure      13C NMR   碳谱模拟图
4 .     Compound 3 minor
    相似度:55.5%
Magnetic Resonance in Chemistry          2006          44          20-24
Assignment of absolute configuration of cyclic secondary amines by NMR techniques using Mosher's method: a general procedure exemplified with (−-isoanabasine (pages 20–24)
Chuan-Qing Kang, Hai-Quan Guo, Xue-Peng Qiu, Xiao-Li Bai, Hai-Bo Yao and Lian-Xun Gao
Structure      13C NMR   碳谱模拟图
5 .     5-(2-methylquinolin-7-yl)-2-phenylbenzonitrile
C23H16N2     相似度:55.5%
Bioorganic & Medicinal Chemistry          2010          18          3026-3035
Structure–activity relationships in a novel series of 7-substituted-aryl quinolines and 5-substituted-aryl benzothiazoles at the metabotropic glutamate receptor subtype 5
Peng Zhang, Mu-Fa Zou, Alice L. Rodriguez, P. Jeffrey Conn, Amy Hauck Newman
Structure      13C NMR   碳谱模拟图
6 .     N-[(1,3-benzodioxol-5-yl)methyl]-3-tert-butyl-1-phenyl-1H-pyrazol-5-amine
    相似度:55.5%
European Journal of Organic Chemistry          2010                   6454-6463
An Efficient Synthesis of 7-(Arylmethyl)-3-tert-butyl-1-phenyl-6,7-dihydro-1H,4H-pyrazolo[3,4-d][1,3]oxazines
Rodrigo Abonia, Juan Castillo, Braulio Insuasty, Jairo Quiroga, Manuel Nogueras and Justo Cobo
Structure      13C NMR   碳谱模拟图
7 .     3-(4-Methoxy-3-prenylphenyl)acrylic acid
C15H18O3     相似度:55.5%
Bioorganic & Medicinal Chemistry          2011          19          5392-5401
Isolation, identification, and biological evaluation of HIF-1-modulating compounds from Brazilian green propolis
Hisanori Hattori, Kensuke Okuda, Tetsuji Murase, Yuki Shigetsura, Kosuke Narise, Gregg L. Semenza, Hideko Nagasawa
Structure      13C NMR   碳谱模拟图
8 .     (S)-3-Benzyl-5-cyclohexyl-1H-benzo[e][1,4]diazepin-2(3H)-one
C22H24N2O     相似度:52.6%
Bioorganic & Medicinal Chemistry          2011          19          1802-1815
Synthesis and biological evaluation of 1,4-benzodiazepin-2-ones with antitrypanosomal activity
John Spencer, Rajendra P. Rathnam, Alan L. Harvey, Carol J. Clements, Rachel L. Clark,Michael P. Barrett, Pui Ee Wong, Louise Male, Simon J. Coles, Simon P. Mackay
Structure      13C NMR   碳谱模拟图
9 .     (R)-4-Chloro-3-hydroxy-3-((E)-4-(2-methoxyphenyl)-2-oxobut-3-enyl)indolin-2-one
C19H16ClNO4     相似度:52.6%
Tetrahedron          2012          68          3843-3850
Asymmetric cross aldol addition of isatins with α,β-unsaturated ketones catalyzed by a bifunctional Brønsted acid–Brønsted base organocatalyst
Guo-Gui Liu, Hua Zhao, Yu-Bao Lan, Bin Wu, Xiao-Fei Huang, Jian Chen, Jing-Chao Tao, Xing-Wang Wang
Structure      13C NMR   碳谱模拟图
10 .     pancritamine
C21H29NO5     相似度:52.3%
Pharmazie          1999          54          535-537
Further alkaloids from the flowers of Pancratium maritimum
D.T.A. Youssef
Structure      13C NMR   碳谱模拟图
11 .     plakortide E
    相似度:52.3%
Tetrahedron          1996          52          377-394
The plakortones, novel bicyclic lactones from the sponge Plakortis halichondrioides: Activators of cardiac SR-Ca2+-pumping ATPase
Ashok D. Patil, Alan J. Freyer, Mark F. Bean, Brad K. Carte, John W. Westley, Randall K. Johnson, Philippe Lahouratate
Structure      13C NMR   碳谱模拟图
Domyallbesttohaveahappylife.
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