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阿lei

铜虫 (小有名气)

[求助] 急求微谱库查询!非常感谢!

C-NMR数据如下(溶剂氯仿):
14.09,14.25,19.58,19.63,30.99,32.13,65.94,67.12,67.16,69.82,69.86,71.57,129.24,131.27,132.77,168.07
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jiaying613

木虫 (小有名气)

【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与,应助指数 +1
阿lei: 金币+10, ★★★很有帮助, 非常感谢! 2013-05-25 22:16:25
查询结果:共查到47个化合物(查询结果仅供参考)  
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1 .     phthalic acid,butyl isobuty ester
    相似度:62.5%
China Journal of Chinese Materia Medica          2007          32          1295-1298
Studies on Chemical Constituents of Phlomis medicinalis II
YU Zhenxi, WANG Gangli, DAI Zhong, BLANBA Ciren, LIN Ruichao
Structure      13C NMR   碳谱模拟图

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2 .     phthalic acid,butyl isobutyl ester
    相似度:62.5%
Chinese Pharmaceutical Journal          2007          42          1295-1298
Studies on Chemical Constituents of Phlomis medicinalis Ⅱ
YU Zhen-xi, WANG Gang-li, DAI Zhong, BIANBA Ci-ren, LIN Rui-chao
Structure      13C NMR   碳谱模拟图

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3 .     butyloxy-(±)-cis-5-(2-butyloxyethyl)cyclopent-2-enol
C15H28O2     相似度:56.2%
Bioorganic & Medicinal Chemistry          2010          18          2920-2929
Synthesis and biological activity of conformationally restricted gypsy moth pheromone mimics
Hao Chen, Yongmei Gong, Regine M. Gries, Erika Plettner
Structure      13C NMR   碳谱模拟图

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4 .     N-(2-acetoxy)-octylphthalimide
C18H23NO4     相似度:56.2%
Bioorganic & Medicinal Chemistry          2009          17          29-34
Arthrobacter sp. lipase immobilization for preparation of enantiopure masked β-amino alcohols
Asha Chaubey, Rajinder Parshad, Pankaj Gupta, Subhash C. Taneja, Ghulam N. Qazi, C.R. Rajan, S. Ponrathnam
Structure      13C NMR   碳谱模拟图

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5 .     butyl isobutyl phthalate
C16H22O4     相似度:56.2%
Chinese Traditional and Herbal Drugs          2012          43          653-657
Chemical constituents in twigs and leaves of Melodinus fusiformis
WANG Ding-wei; LUO Xiao-dong; JIANG Bei
Structure      13C NMR   碳谱模拟图

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6 .     Asiaticin
C19H20O4     相似度:52.9%
Journal of Asian Natural Products Research          2007          9          407-414
Chemical constituents of Centella asiatica
B. S. SIDDIQUI, H. ASLAM, S. T. ALI, S. KHAN and S. BEGUM
Structure      13C NMR   碳谱模拟图

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7 .     Cotonoate A
C17H24O4     相似度:52.9%
Zeitschrift für Naturforschung B          2008          63b          1219-1222
Cotonoates A and B, New Aromatic Esters from Cotoneaster racemiflora
Shafiullah Khan, Shazia Yasmeen, Nighat Afza, Abdul Malik, Lubna Iqbal, and Mehreen Lateef
Structure      13C NMR   碳谱模拟图

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8 .     micropine
C17H29NO2     相似度:52.9%
Phytochemistry          1990          29          2309-2313
A major piperidine alkaloid from Microcos Philippinensis
Alicia M. Aguinaldo,Roger W. Read
Structure      13C NMR   碳谱模拟图

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9 .     benzyl (2,3,4-tri-O-acetyl-α/β-D-glucopyran)uronate
C19H22O10     相似度:52.9%
Bioorganic & Medicinal Chemistry          2008          16          6312-6318
Duocarmycin-based prodrugs for cancer prodrug monotherapy
Lutz F. Tietze, Heiko J. Schuster, Kianga Schmuck, Ingrid Schuberth, Frauke Alves
Structure      13C NMR   碳谱模拟图

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10 .     spatozoate
    相似度:52.9%
The Journal of Antibiotics          2011          64          205-209
Glucopiericidin C: a cytotoxic piericidin glucoside antibiotic produced by a marine Streptomyces isolate
Khaled A Shaaban, Elisabeth Helmke, Gerhard Kelter, Heinz Herbert Fiebig and Hartmut Laatsch
Structure      13C NMR   碳谱模拟图

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11 .     spatozoate
    相似度:52.9%
Indian Journal of Chemistry          2003          42B          1190-1192
Revised structure for spatozoate a metabolite of Spatoglossum variabile
Kur-Ta Cheng, Dodda Rajasekhar, et al.
Structure      13C NMR   碳谱模拟图

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12 .     benzyl n-butyl phthalate
    相似度:52.9%
Indian Journal of Chemistry          2003          42B          1190-1192
Revised structure for spatozoate a metabolite of Spatoglossum variabile
Kur-Ta Cheng, Dodda Rajasekhar, et al.
Structure      13C NMR   碳谱模拟图

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13 .     2-[(2R)-2-Methyl-3-[2H3]methyl-3-phenylsulfonyl-[4-2H3]butyloxy]tetrahydro-2H-pyran
C12H11D6O3S     相似度:52.6%
Steroids          2002          67          1101-1108
Synthesis of hexadeuterated 23-dehydroxybrassinosteroids
Vladimir A. Khripach, Vladimir N. Zhabinskii, Andrey P. Antonchick, Olga V. Konstantinova, Bernd Schneider
Structure      13C NMR   碳谱模拟图

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14 .     compound V-7d
C21H25N3O3     相似度:52.6%
Journal of Agricultural and Food Chemistry          2010          58          3651-3660
Synthesis and Fungicidal Activity of Novel Aminophenazine-1-carboxylate Derivatives
Ming-Zhong Wang, Han Xu, Shu-Jing Yu, Qi Feng, Su-Hua Wang and Zheng-Ming Li
Structure      13C NMR   碳谱模拟图

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15 .     ZP-amide D
C16H27NO4     相似度:50%
Phytochemistry          2004          65          2599-2604
Aliphatic acid amides of the fruits of Zanthoxylum piperitum
Tsutomu Hatano, Kazutoshi Inada, Tomo-omi Ogawa, Hideyuki Ito, Takashi Yoshida
Structure      13C NMR   碳谱模拟图

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16 .     peyssonenyne B
C23H30O6     相似度:50%
Journal of Natural Products          2004          67          1010-1013
Peyssonenynes A and B, Novel Enediyne Oxylipins with DNA Methyl Transferase Inhibitory Activity from the Red Marine Alga Peyssonnelia caulifera
Kerry L. McPhail, Dennis France, Susan Cornell-Kennon, and William H. Gerwick
Structure      13C NMR   碳谱模拟图
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