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lcyscau

木虫 (正式写手)

[求助] 微谱数据求助

碳谱数据如下,溶剂是氘代氯仿,谢谢啦!
16.8,21.1,21.4,25.8,28.7,39.0,45.1,56.9,66.2,122.3,130.6,139.6,151.4,171.0
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lifeliuyan

至尊木虫 (职业作家)

【答案】应助回帖

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感谢参与,应助指数 +1
lcyscau: 金币+20, ★★★★★最佳答案, thank you so much 2013-11-19 12:41:06
查询结果:共查到148个化合物(查询结果仅供参考)  
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1 .     {(1R,2Z,3S,5R)-3-(2,2-dimethylpropanoyl)-6,6-dimethylbicyclo[3.1.1]hept-2-ylidene]methyl N,N-diisopropylcarbamate
C22H37NO3     相似度:60%
European Journal of Organic Chemistry          2010                   3711-3720
(–)-Myrtenyl N,N-Diisopropylcarbamate: Stereochemistry of Lithiation and Electrophilic Substitution Directed by Dynamic Kinetic Diastereoisomer Resolution
Thérèse Hémery, Jochen Becker, Roland Fröhlich and Dieter Hoppe
Structure      13C NMR   碳谱模拟图

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2 .     2,5,7-trimethyl-1-oxo-6-vinyl-indan-2-yl-carboxylic acid ethylester
C17H20O3     相似度:60%
Tetrahedron          2013          69          2572-2576
Synthesis of (±)-pterosin A via Suzuki–Miyaura cross-coupling reaction
Shao-Chien Hsu, Mogili Narsingam, Yi-Fang Lin, Feng-Lin Hsu, Biing-Jiun Uang
Structure      13C NMR   碳谱模拟图

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3 .     (+)-boscialin
C13H22O3     相似度:57.1%
Journal of Natural Products          1998          61          591-597
Total Synthesis and Biological Activities of (+)- and (-)-Boscialin and Their 1'-Epimers
Joachim Busch, Yvonne Grether, Dietmar Ochs, and Urs Séquin
Structure      13C NMR   碳谱模拟图

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4 .     boscialin
     相似度:57.1%
China Journal of Chinese Materia Medica          2010          35          3302-3305
Chemical constituents from flowers of Chrysanthemum indicum
FENG Ziming; YANG Yanan; JIANG Jianshuang; ZHANG Peicheng
Structure      13C NMR   碳谱模拟图

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5 .     3-isobutyl-7-methyl-1,3-dihydro-2H-indol-2-one
C13H17NO     相似度:57.1%
Heterocycles          2006          68          539-547
Unexpected 7-Methylation of Oxindoles
Balázs Volk,* Rita Kapiller-Dezsöfi, and Gyula Simig
Structure      13C NMR   碳谱模拟图

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6 .     (1R,7R,10S)-7-(1-Methylethyl)-10-methylbicyclo[4.4.0]dec-5-en-4-one
C14H22O     相似度:57.1%
Journal of the Chemical Society, Perkin Transactions 1          2000                   189-194
Synthesis of sesquiterpene allylic alcohols and sesquiterpene dienes from Cupressus bakeri and Chamaecyparis obtusa
Koon-Sin Ngo and Geoffrey D. Brown
Structure      13C NMR   碳谱模拟图

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7 .     trans-3-isopropyl-6-methylchroman-4-ol
     相似度:57.1%
Journal of the Chemical Society, Perkin Transactions 1          1975                   543-548
The biosynthesis of fungal metabolites. Part V. Structure of variecoxanthones A, B, and C, metabolites of Aspergillus variecolor; conversion of variecoxanthone A into (±)-de-C-prenylepishamixanthone
Kuldip K. Chexal, John S. E. Holker, Thomas J. Simpson and Kenneth Young
Structure      13C NMR   碳谱模拟图

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8 .     compound 21
C15H22O4     相似度:57.1%
Heterocycles          2000          52          1315-1328
A Highly Efficient Synthetic Route to (-)-Furaquinocin C
Amos B. Smith, III*, José Pérez Sestelo, and Peter G. Dormer
Structure      13C NMR   碳谱模拟图

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9 .     4-keto-15-nor-amorph-5-ene
C14H22O     相似度:57.1%
Tetrahedron          1999          55          15109-15126
Autoxidation of 4-amorphen-11-ol and the biogenesis of nor- and seco-amorphane sesquiterpenes from fabiana imbricata
Koon-Sin Ngo, Geoffrey D. Brown
Structure      13C NMR   碳谱模拟图

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10 .     8-phenoxycarbonyl-1,8-diazabicyclo[5.4.0]undec-7-enium chloride
C16H21ClN2O2     相似度:57.1%
European Journal of Organic Chemistry          2011                   2458-2465
DBU-Promoted Nucleophilic Activation of Carbonic Acid Diesters
Marianna Carafa, Ernesto Mesto and Eugenio Quaranta
Structure      13C NMR   碳谱模拟图

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11 .     compound 4
     相似度:57.1%
European Journal of Organic Chemistry          2010                   5967-5979
Synthesis and Evaluation of Pseudopeptidic Fluorescence pH Probes for Acidic Cellular Organelles: In Vivo Monitoring of Bacterial Phagocytosis by Multiparametric Flow Cytometry
M. Isabel Burguete, Francisco Galindo, M. Angeles Izquierdo, José-Enrique O'Connor, Guadalupe Herrera, Santiago V. Luis and Laura Vigara
Structure      13C NMR   碳谱模拟图

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12 .     2-{[(1R,3S,4R,6S)-4,7,7-Trimethylbicyclo[4.1.0]hept-3-yl]sulfanyl}-1H-benzimidazole
C17H22N2S     相似度:57.1%
Helvetica Chimica Acta          2012          95          940-950
Synthesis and Asymmetric Oxidation of (Caranylsulfanyl)-1H-imidazoles
Marina Y. Demakova, Denis V. Sudarikov, Svetlana A. Rubtsova, Larisa L. Frolova, Alexey V. Popov, Pavel A. Slepukhin and Alexander V. Kuchin
Structure      13C NMR   碳谱模拟图

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13 .     (-)-(1S,3R,4S,6S)-6-Hydroxymenthyl diacetate
     相似度:57.1%
Journal of Agricultural and Food Chemistry          2003          51          1880-1883
Lytic Activity of l-Menthol Derivatives against the Snow Blight Disease Fungus, Micronectriella nivalis
Mitsuo Miyazawa, Hideki Kawazoe, Yuji Sumi, and Mitsuro Hyakumachi
Structure      13C NMR   碳谱模拟图

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14 .     3-Isocyanotheonellin
     相似度:57.1%
The Journal of Organic Chemistry          1986          51          5136-5139
Nitrogenous bisabolene sesquiterpenes from marine invertebrates
Nanda K. Gulavita, E. Dilip De Silva, Mark R. Hagadone, Peter Karuso, Paul J. Scheuer, Gregory D. Van Duyne, Jon Clardy
Structure      13C NMR   碳谱模拟图

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15 .     boscialin
     相似度:57.1%
Helvetica Chimica Acta          1990          73          578-582
Boscialin and Boscialin 4′-O-Glucoside, Two New Compounds Isolated from the Leaves of Boscia salicifolia OLIV
Niklaus Pauli, Urs Séquin and Angelika Walter
Structure      13C NMR   碳谱模拟图

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16 .     parthenin
     相似度:53.3%
Helvetica Chimica Acta          2008          Vol. 91          1137
Two New Pseudoguaianolides from the Flowers of Parthenium hysterophorus
Biswanath Das, Kongara Ravinder Reddy, Bommena Ravikanth, Akella Venkata Subrahmanya Sarma, and Balasubramanian Sridhar
Structure      13C NMR   碳谱模拟图

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17 .     parthenin
     相似度:53.3%
Phytochemistry          2007          68          2029-2034
Acetylated pseudoguaianolides from Parthenium hysterophorus and their cytotoxic activity
Biswanath Das, V. Saidi Reddy, M. Krishnaiah, A.V.S. Sharma, K. Ravi Kumar,J. Venkateswara Rao, V. Sridhar
Structure      13C NMR   碳谱模拟图

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18 .     parthenin
     相似度:53.3%
Phytochemistry          2003                   841-844
Pseudoguaianolides from the flowers of Parthenium hysterophorus
C. Ramesha, N. Ravindranath, Biswanath Das, A. Prabhakar, Jagadeesh Bharatam,K. Ravikumar, A. Kashinatham, T.C. McMorris
Structure      13C NMR   碳谱模拟图

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19 .     secoinfuscanal
C15H24O2     相似度:53.3%
Journal of Natural Products          2001          64          1309-1317
Sesqui- and Diterpenoids from the Japanese Liverwort Jungermannia infusca
Fumihiro Nagashima,Makoto Suzuki, Shigeru Takaoka, and Yoshinori Asakawa
Structure      13C NMR   碳谱模拟图

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20 .     8,10-epoxy-9-acetoxythymol angelate
     相似度:53.3%
Planta Medica          1993          59          480-481
New Acetophenone and Thymol Derivatives from Eupatorium stoechadosmum
Nguyen thi Diem Trang, Martin J. Wanner,Gerrit-Jan Koomen. and Nguyen xuan Dung
Structure      13C NMR   碳谱模拟图

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21 .     compound 13
C15H26O4S     相似度:53.3%
Chemical & Pharmaceutical Bulletin          1994          42          2430-2435
Crude Drugs from Aquatic Plants. V. On the Constituents of Alismatis Rhizoma. (3). Stereostructures of Water-Soluble Bioactive Sesquiterpenes, Sulfoorientalols a, b, c, and d, from Chinese Alismatis Rhizoma
Masayuki YOSHIKAWA,Shoko YAMAGUCHI,Hisashi MATSUDA,Nobumitsu TANAKA,Johji YAMAHARA and Nobutoshi MURAKAMI
Structure      13C NMR   碳谱模拟图

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22 .     compound 4
C15H26O4S     相似度:53.3%
Chemical & Pharmaceutical Bulletin          1993          41          1194-1196
SULFOORIENTALOLS a, b, c, AND d, FOUR NEW BIOLOGICALLY ACTIVE SESQUITERPENES, FROM ALISMATIS RHIZOMA
Masayuki YOSHIKAWA,Youich FUKUDA,Shoko HATAKEYAMA,Nobumitsu TANAKA,Hisashi MATSUDA,Johji YAMAHARA and Nobutoshi MURAKAMI
Structure      13C NMR   碳谱模拟图
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