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linkus1988

木虫 (正式写手)

[求助] 求助微谱数据查询

溶剂:氯仿
相似度:50%以上
碳谱数据:170.2,151.8,145.8,142.9,140.4,14.5
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【答案】应助回帖

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linkus1988: 金币+5, ★★★★★最佳答案, 神速啊 2012-12-31 14:38:06
查询结果:共查到23个化合物(查询结果仅供参考)  
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1 .     1-(5-acetyl-3,4-dimethyl-thieno[2,3-b]thiophen-2-yl)-ethanone
C12H12O2S2     相似度:71.4%
Journal of Heterocyclic Chemistry          2001          38          1167-1171
Efficient one pot preparation of variously substituted thieno [2,3-b] thiophene
Alain Cornel and Gilbert Kirsch
Structure      13C NMR   碳谱模拟图

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2 .     2-(Cyanomethyl)but-2-enoic acid
C7H9NO2     相似度:50%
Molecules          2008          13          716-728
An Efficient Synthesis of γ-Aminoacids and Attempts to Drive Its Enantioselectivity
Salvador Gil, Margarita Parra and Pablo Rodríguez
Structure      13C NMR   碳谱模拟图

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3 .     (E)-5-chloro-1,3-dimethyl-1H-pyrazol-4-carbaldehyde oxime
C6H8ClN3O     相似度:50%
Journal of Heterocyclic Chemistry          2003          40          303-308
Synthesis of substituted 3-phenyl-6h-pyrazolo[4,3-d]isoxazoles from corresponding 4-benzoyl-5-hydroxypyrazoles
Wolfgang Holzer and Katharina Hahn
Structure      13C NMR   碳谱模拟图

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4 .     3,4-dimethylthieno[2,3-b]thiophene-2,5-dicarbonitrile
C10H6N2S2     相似度:50%
Journal of Heterocyclic Chemistry          2001          38          1167-1171
Efficient one pot preparation of variously substituted thieno [2,3-b] thiophene
Alain Cornel and Gilbert Kirsch
Structure      13C NMR   碳谱模拟图

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5 .     tetracyanothianthrene
C24H20N4S2     相似度:50%
Heterocycles          2010          80          183-186
Photolytic Preparation of Tetrabromothianthrene and Its Transformation to Dinuclear Phthalocyanines
Takeshi Kimura, Takeru Obonai, Takayuki Nozaki, Kenji Matsui, Toshiharu Namauo, Akio Yamakawa, and Yutaka Takaguchi
Structure      13C NMR   碳谱模拟图

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6 .     2,5-diethoxy-3,6-diisopropylpyrazine
C14H24N2O2     相似度:50%
Heterocycles          2010          81          1239-1251
Synthesis of (3S)-2,5-Diethoxy-3,6-dihydro-3-isopropyl-6-methylsulfanylpyrazines and Stereoselectivity in Alkylation of the Anions
Yoshihide Usami, Masao Arimoto, Chisaka Kioka, Masako Yamanaka, Naoko Matsuda, and Hayato Ichikawa
Structure      13C NMR   碳谱模拟图

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7 .     2-methylthiobenzimidazole
    相似度:50%
Heterocycles          2010          81          413-420
S-Methylation of N-Containing Heterocyclic Thiols with Conjugated Acids of Methoxy Groups
Masao Shimizu, Teruaki Shimazaki, Yoshihiro Kon, and Takeo Konakahara
Structure      13C NMR   碳谱模拟图

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8 .     3-chloro-4-(1-ethoxyvinyl)-1,2,5-thiadiazole
C6H7N2OClS     相似度:50%
Heterocycles          2003          60          29-45
The Palladium-catalyzed Cross-coupling reactions of 3-Chloro-4-halogeno-1,2,5-thiadiazoles
Alain Merschaert* and Hugo J. Gorissen
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

9 .     Compound 7
    相似度:50%
Magnetic Resonance in Chemistry          2009          47          617-624
Derivatives of pyrazinecarboxylic acid: 1H, 13C and 15N NMR spectroscopic investigations (pages 617–624)
Wolfgang Holzer, Gernot A. Eller, Barbara Datterl and Daniela Habicht
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

10 .     Compound 14
    相似度:50%
Magnetic Resonance in Chemistry          2009          47          617-624
Derivatives of pyrazinecarboxylic acid: 1H, 13C and 15N NMR spectroscopic investigations (pages 617–624)
Wolfgang Holzer, Gernot A. Eller, Barbara Datterl and Daniela Habicht
Structure      13C NMR   碳谱模拟图

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11 .     2-Methylmonomethylfumarate
    相似度:50%
Tetrahedron Letters          2002          43          2555-2559
Isoprenoid biosynthesis via the methylerythritol phosphate pathway. (E)-4-Hydroxy-3-methylbut-2-enyl diphosphate: chemical synthesis and formation from methylerythritol cyclodiphosphate by a cell-free system from Escherichia coli
Murielle Wolff, Myriam Seemann, Catherine Grosdemange-Billiard, Denis Tritsch, Narciso Campos, Manuel Rodrı́guez-Concepción, Albert Boronat, Michel Rohmer
Structure      13C NMR   碳谱模拟图

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12 .     compound 5b
    相似度:50%
Tetrahedron Letters          2005          46          69-74
Alkynylation of N-tosylimines with aryl acetylenes promoted by ZnBr2 and N,N-diisopropylethylamine in acetonitrile
Ka Young Lee, Chang Gon Lee, Jeong Eun Na, Jae Nyoung Kim
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

13 .     3-Methyl-1-(p-nitrophenyl)pyrazole-5-thiol
C10H9N3O2S     相似度:50%
Archiv der Pharmazie          2002          335          99-103
Preparation and Antibacterial Activity of 3-Methyl-1-p-substituted Phenylpyrazole-5-thiol
Yoshinobu Tagawa, Shin'ichi Minami, Toshio Yoshida, Keitaro Tanaka, Shuji Sato, Yoshinobu Goto and Kenji Yamagata
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

14 .     1,2,3,4,6,7,8,9-octaethyl-5-stannaspirononatetraene
C24H40Sn     相似度:50%
Heterocycles          2000          52          1171-1189
Preparation of Sn-, Ge-, and Si-Heterocycles from Zirconacycles
Yasuyuki Ura, Yanzhong Li, Fu-Yu Tsai, Kiyohiko Nakajima, Martin Kotora, and Tamotsu Takahashi*
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

15 .     gallic acid
    相似度:50%
Natural Product Research and Development          2008          20          447-449
Chemical Constituents from Glochidion puberum
ZHANG Zhen;LIU Guang-ming; REN Yan-li; HE Hong-ping; HAO Xiao-jiang
Structure      13C NMR   碳谱模拟图

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16 .     gallic acid
    相似度:50%
Natural Product Research and Development          2006          18          74-75
Chemical Constituents of Balanophora japonica Makino
RUAN Han-li; ZHANG Yong-hui; PI Hui-fang; ZHAO Wei; WU Ji-zhou (
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

17 .     2-(4-pyridyl)-isothiazol-3(2H)-one
C8H6N2OS     相似度:50%
Bioorganic & Medicinal Chemistry          2009          17          467-474
Synthesis of isothiazol-3-one derivatives as inhibitors of histone acetyltransferases (HATs)
Stephen Gorsuch, Vassilios Bavetsias, Martin G. Rowlands, G. Wynne Aherne, Paul Workman, Michael Jarman, Edward McDonald
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

18 .     5-chloro-1,3-dimethyl-4-nitro-1H-pyrazole
C5H6ClN3O2     相似度:50%
Russian Journal of Organic Chemistry          2006          42          901-906
Synthesis and properties of 5-chloro-4-nitropyrazoles
G. V. Bozhenkov, V. A. Savosik, L. I. Larina, A. N. Mirskova and G. G. Levkovskaya
Structure      13C NMR   碳谱模拟图

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19 .     2-(2H-tetrazol-5-yl)pyrazine
    相似度:50%
European Journal of Organic Chemistry          2011                   6343-6355
Highly Efficient Synthesis of 5-Substituted 1H-Tetrazoles Catalyzed by Cu–Zn Alloy Nanopowder, Conversion into 1,5- and 2,5-Disubstituted Tetrazoles, and Synthesis and NMR Studies of New Tetrazolium Ionic Liquids
Gopalakrishnan Aridoss and Kenneth K. Laali
Structure      13C NMR   碳谱模拟图

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20 .     syringic acid
    相似度:50%
Chinese Journal of Natural Medicines          2011          9          185-187
Chemical Constituents of Parabarium huaitingii
LEI Ting, JIANG Hai-Yan, HU Ying, CEN Ying-Zhou
Structure      13C NMR   碳谱模拟图

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21 .     2-[(Methylthio)methyl]-2-butenal
    相似度:50%
Journal of Agricultural and Food Chemistry          1996          44          3598-3600
Synthesis of 2-[(Methylthio)methyl]-2-butenal, a Characteristic Flavor Component of Potato Chips, Krill Seasoning, Roasted Coffee, and Yeast Extracts
Norbert G. De Kimpe and Wim A. Aelterman
Structure      13C NMR   碳谱模拟图

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22 .     4-Ethylnitrobenzene
    相似度:50%
Tetrahedron          2012          68          8293-8299
Chemoselective hydrogenation using molecular sieves-supported Pd catalysts: Pd/MS3A and Pd/MS5A
Tohru Takahashi, Masatoshi Yoshimura, Hiroyasu Suzuka, Tomohiro Maegawa, Yoshinari Sawama, Yasunari Monguchi, Hironao Sajiki
Structure      13C NMR   碳谱模拟图

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23 .     4-methyl-3-methylthio-1,2,4-triazin-5(4H)-one
    相似度:50%
Australian Journal of Chemistry          1985          38          1809-1813
1,2,4-Triazines. 1. The Use of C-13 Nuclear-Magnetic-Resonance Spectroscopy to Determine the Methylation Products of 3-Methylthio-1,2,4-Triazin-5(2h)-One
NW Jacobsen and SE Rose
Structure      13C NMR   碳谱模拟图
2楼2012-12-31 12:58:48
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