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zhaocaigui

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[求助] 微谱求助一化合物结构

13C NMR (101 MHz, CDCl3) δ   
52.82,112.88,117.50,131.14,132.35,132.51,132.73,134.79,164.46
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【答案】应助回帖

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zhaocaigui(豆哥代发): 金币+8, 谢谢 2013-09-21 11:23:23
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186个化合物(查询结果仅供参考)
1 .     Methyl 2,5-dichlorobenzoate
    相似度:77.7%
Zeitschrift für Naturforschung B          2008          63          1291-1299
Electroreduction of Organic Compounds, 36. Electroreduction of Chlorinated Methyl Benzoates
J. Gassmann and J. Voss
Structure      13C NMR   碳谱模拟图
2 .     furan-2-yl(2-methoxy-2-oxoethyl)diphenylphosphonium bromide
C19H18BrO3P     相似度:72.7%
Tetrahedron          2013          69          7395-7402
Annelated P-containing heterocycles from aryl- and hetaryl-substituted phosphonium iodonium ylides with a methoxycarbonyl-group Original Research Article
Elena D. Matveeva, Tatyana A. Podrugina, Marina A. Taranova, Ekaterina Yu. Melikhova, Rolf Gleiter, Nikolay S. Zefirov
Structure      13C NMR   碳谱模拟图
3 .     iminophosphorane
    相似度:66.6%
The Journal of Organic Chemistry          2002          67          7797-7801
Thermolysis of Benzannulated Enyne−Carbodiimides. Application in the Synthesis of Pyrido[1‘,2‘:1,2]pyrimido[4,5-b]indoles and Related Heteroaromatic Compounds
Xiaoling Lu, Jeffrey L. Petersen, and Kung K. Wang
Structure      13C NMR   碳谱模拟图
4 .     methyl (E)-3-phenyl-3-trifluoromethylsulfonyloxy-2-propenoate
    相似度:66.6%
Russian Journal of Organic Chemistry          2005          41          1485-1492
Protonation of 3-Arylpropynoic Acid Derivatives in Superacids
S. Walspurger, A. V. Vasil'ev, J. Sommer, P. Pale and P. Yu. Savechenkov, et al.
Structure      13C NMR   碳谱模拟图
5 .     α,α'-bis(4-trifluoromethylbenzylammonium)-p-xylene bis(hexafluorophosphate)
C24H24F18N2P2     相似度:66.6%
European Journal of Organic Chemistry          2011                   759-769
Synthesis and Complexation Studies between Trifluoromethylammonium Threads and Dibenzo[24]Crown-8
Carsten Johnsen, Paul C. Stein, Kent A. Nielsen, Andrew D. Bond and Jan O. Jeppesen
Structure      13C NMR   碳谱模拟图
6 .     (Z)-methyl 2-chloro-3-(4-cyanophenyl)acrylate
    相似度:66.6%
European Journal of Organic Chemistry          2011                   1015-1022
Biocatalyzed Enantioselective Reduction of Activated C=C Bonds: Synthesis of Enantiomerically Enriched -Halo-β-arylpropionic Acids
Elisabetta Brenna, Francesco G. Gatti, Alessia Manfredi, Daniela Monti and Fabio Parmeggiani
Structure      13C NMR   碳谱模拟图
7 .     H-Phe(3-CN)-OMe×HCl
C11H12N2O2     相似度:60%
Bioorganic & Medicinal Chemistry          2011          19          7236-7243
The arginine mimicking β-amino acid β3hPhe(3-H2N-CH2) as S1 ligand in cyclotheonamide-based β-tryptase inhibitors
Dennis Janke, Christian P. Sommerhoff, Norbert Schaschke
Structure      13C NMR   碳谱模拟图
8 .     (Z)-Ethyl 3-(4-trifluoromethylphenylseleno)acrylate
C12H11F3O2Se     相似度:60%
Tetrahedron          2012          68          10523-10529
Palladium-catalyzed vinylselenation of allenes
Shin-ichi Fujiwara, Maiko Okuyama, Susumu Tsuda, Takanori Iwasaki, Hitoshi Kuniyasu, Nobuaki Kambe
Structure      13C NMR   碳谱模拟图
9 .     Methyl 2-formylbenzoate
    相似度:55.5%
Bioorganic & Medicinal Chemistry          2011          19          939-950
Microwave-assisted synthesis of quinoline, isoquinoline, quinoxaline and quinazoline derivatives as CB2 receptor agonists
Raimo Saari, Jonna-Carita Törmä, Tapio Nevalainen
Structure      13C NMR   碳谱模拟图
10 .     2-Nitro-3-thienylmethyltriphenylphosphonium bromide
    相似度:55.5%
Canadian Journal of Chemistry          2008          86          668-675
Effect of base on alkyltriphenylphosphonium salts in polar aprotic solvents
Julius N. Ngwendson, Cassandra M. Schultze, Jordan W. Bollinger, and Anamitro Banerjee
Structure      13C NMR   碳谱模拟图
11 .     compound 6a
C25H25BNP     相似度:55.5%
Tetrahedron Letters          2000          41          6143-6147
Addition of borane-protected secondary phosphines to imines. A route to protected mono-N-substituted-α-aminophosphines
Batia Ben-Aroya Bar-Nir, Moshe Portnoy
Structure      13C NMR   碳谱模拟图
12 .     (5Z)-1,5,7-octatrien-4-ol
C8H12O     相似度:55.5%
Organic letters          2000          2          3897-3899
Syntheses with Organoboranes. XI. Allylboration of Vinylic Epoxides with Allylic Dialkylboranes
Marek Zaidlewicz and Marek P. Krzemiński
Structure      13C NMR   碳谱模拟图
13 .     methyl (Z)-3-(4-chlorophenyl)-2-(mercaptomethyl)prope-noate
C11H11ClO2S     相似度:55.5%
Journal of Heterocyclic Chemistry          2009          46          23-27
A new route to allyl thiols and allyl thiocarbamates from Baylis-Hillman adducts
Young-Gi Kim,Hee Nam Lim and Kee-Jung Lee
Structure      13C NMR   碳谱模拟图
14 .     methyl 2-benzamidoacrylate
C11H11NO3     相似度:55.5%
Journal of Heterocyclic Chemistry          2009          46          1235-1238
Novel and convenient to substituted imidazoles
Yu-An Chang and Hsiang Chang
Structure      13C NMR   碳谱模拟图
15 .     5-bromo-2,4-dichloro benzoic acid
    相似度:55.5%
Journal of Heterocyclic Chemistry          2007          44          273-275
An improved synthesis of 1-acetyl-1H-indol-3-yl acetates
Juan C. Rodríguez-Domínguez,Alexander Balbuzano-Deus,Miguel A. López-López,Juan C. Rodríguez-Domínguez and Gilbert Kirsch
Structure      13C NMR   碳谱模拟图
16 .     1-(4-cyanobenzyl)-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]-decane bromide
C14H18BrN5     相似度:55.5%
Journal of Heterocyclic Chemistry          2003          40          229-241
Preparation of a clinically investigated ras farnesyl transferase inhibitor
Peter E. Maligres,Marjorie S. Waters,Steven A. Weissman,J. Christopher McWilliams,Stephanie Lewis,Jennifer Cowen,Robert A. Reamer,R. P. Volante,Paul J. Reider and David Askin
Structure      13C NMR   碳谱模拟图
17 .     7-loro-4-(hydroxyamino)-3-nitroquinolin-2(1H)-one
C9H6ClN3O4     相似度:55.5%
Journal of Heterocyclic Chemistry          2003          40          617-623
Synthesis and biological properties of 4-substituted quinolin-2(1H)-one analogues
Jae-Chul Jung,Seikwan Oh,Won-Ki Kim,Woo-Kyu Park,Jae Yang Kong and Oee-Sook Park
Structure      13C NMR   碳谱模拟图
18 .     compound 3g
C11H8BrNO     相似度:55.5%
Journal of Heterocyclic Chemistry          2000          37          15-24
Synthesis and nuclear magnetic resonance spectroscopic studies of 1-arylpyrroles
Chang Kiu Lee, Jung Ho Jun and Ji Sook Yu
Structure      13C NMR   碳谱模拟图
19 .     3-(1H-tetrazole-5-yl)benzonitrile
    相似度:55.5%
Journal of Heterocyclic Chemistry          2010          47          913-922
Clay-catalyzed synthesis of 5-substituent 1-H-tetrazoles
Alireza Najafi Chermahini, Abbas Teimouri, Fariborz Momenbeik, Amin Zarei, Zeinab Dalirnasab, Aseyeh Ghaedi and Mostafa Roosta
Structure      13C NMR   碳谱模拟图
20 .     dibenzo[b,f]thiepine-10,11-dione
    相似度:55.5%
Heterocycles          2009          78          2489-2507
2,8-Dithia-dibenzo[e,h]azulenes and Their 8-Oxa Analogs. Synthesis and Anti-inflammatory Activity
Ivana Ozimec Landek, Dijana Pešić, Predrag Novak, Barbara Stanić, Krunoslav Nujić, Mladen Merćep, and Milan Mesić
Structure      13C NMR   碳谱模拟图
21 .     Compound 8
    相似度:55.5%
Bioorganic & Medicinal Chemistry Letters          1991          1          635-638
New stereospecific synthesis of (E,E,Z)- and (E,E,E)-10,12,14-hexadecatrienal sex pheromonal components of Manducta sexta
Frédérique Tellier
Structure      13C NMR   碳谱模拟图
22 .     Compound 9
    相似度:55.5%
Bioorganic & Medicinal Chemistry Letters          1991          1          635-638
New stereospecific synthesis of (E,E,Z)- and (E,E,E)-10,12,14-hexadecatrienal sex pheromonal components of Manducta sexta
Frédérique Tellier
Structure      13C NMR   碳谱模拟图
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2楼2013-09-16 13:37:09
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