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a89812

金虫 (正式写手)

[求助] 微谱数据求助,谢谢

43.01, 51.99, 53.19, 73.20, 170.20, 173.81
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jasminelw

铁杆木虫 (正式写手)

【答案】应助回帖

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感谢参与,应助指数 +1
a89812: 金币+10, ★★★★★最佳答案, 非常感谢 2013-04-28 19:04:36
1 .     trimethyl citrate
    相似度:100%
China Journal of Chinese Materia Medica          2008          33          1272-1274
Studies on chemical constituents of Dioscorea opposita
BAI Bing, LI Mingjing, WANG Yong, LIU Xiuhua
Structure      13C NMR   碳谱模拟图

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

2 .     柠檬酸三甲酯
C9H14O7     相似度:100%
Chinese Traditional and Herbal Drugs          1995          26          105-106
乌梅的化学成分研究
沈红梅,易杨华,乔传卓,苏中武,李承祜
Structure      13C NMR   碳谱模拟图

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

3 .     trimethyl citrate
    相似度:100%
Journal of Shenyang Pharmaceutical University          2008          25          705-707
Chemical constituents of water-soluble part of Mentha spicata L.
SONG Yan, CHEN Guang-tong, SUN Bo-hang, HUANG Jian, LI Xian, WU Li-jun
Structure      13C NMR   碳谱模拟图

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

4 .     2-methyl-3-(p-nitrophenyl)-5-phenyltetrahydropyrrolo[3,4-d]-isoxazol-4,6-dione
C18H15N3O5     相似度:83.3%
Journal of Heterocyclic Chemistry          2004          41          741-746
Structural characterization of isomeric 2,3,5-substituted tetrahydropyrrolo[3,4-d]isoxazole-4,6-diones prepared by cycloaddition of N-methyl-C-arylnitrones to N-phenyl-or N-methylmaleimide
Kalevi Pihlaja,Petri Thtinen,Roustem Shaikhutdinov,Heli Hartikainen,Vladimir Ovcharenko,Hikmet Agirbas and Selahaddin Güner
Structure      13C NMR   碳谱模拟图

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

5 .     3-(p-chlorophenyl)-2-methyl-5-phenyltetrahydropyrrolo[3,4-d]-isoxazol-4,6-dione
C18H15ClN2O3     相似度:83.3%
Journal of Heterocyclic Chemistry          2004          41          741-746
Structural characterization of isomeric 2,3,5-substituted tetrahydropyrrolo[3,4-d]isoxazole-4,6-diones prepared by cycloaddition of N-methyl-C-arylnitrones to N-phenyl-or N-methylmaleimide
Kalevi Pihlaja,Petri Thtinen,Roustem Shaikhutdinov,Heli Hartikainen,Vladimir Ovcharenko,Hikmet Agirbas and Selahaddin Güner
Structure      13C NMR   碳谱模拟图

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

6 .     3-羟基-3-羧基戊二酸二甲酯
C8H12O7     相似度:83.3%
Chinese Traditional and Herbal Drugs          1995          26          105-106
乌梅的化学成分研究
沈红梅,易杨华,乔传卓,苏中武,李承祜
Structure      13C NMR   碳谱模拟图

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

7 .     3-羟基-3-甲酯基戊二酸
C7H10O7     相似度:83.3%
Chinese Traditional and Herbal Drugs          1995          26          105-106
乌梅的化学成分研究
沈红梅,易杨华,乔传卓,苏中武,李承祜
Structure      13C NMR   碳谱模拟图

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

8 .     1,5-dimethyl citrate
    相似度:83.3%
Journal of Shenyang Pharmaceutical University          2009          26          807-810
Isolation and identification of chemical constituents from the fruit and calyx of Physalis alkekengi L. var. franchetii(Mast.)Makino
CAI Qian, LIU Yu-qiang, MA Zhe
Structure      13C NMR   碳谱模拟图

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

9 .     1,5-dimethyl citrate
    相似度:83.3%
Natural Product Research and Development          2009          21          731-732
Studies on the Metabolites of Aspergillus aculeatus YM 311498,an Endophytic Fungus from Azadirachta indica A.Juss
WU Shao-hua; CHEN You-wei; SHAO Shi-cheng; LI Zhi-ying; YANG Li-yuan; LI Shao-lan
Structure      13C NMR   碳谱模拟图

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

10 .     1,5-dimethyl citrate
C8H12O7     相似度:83.3%
Natural Product Research and Development          2004          16          129-130
STUDIES ON THE CHEMICAL CONSTITUENTS OF EMBELIA LAETA
TANG Tian-jun;WU Feng-e
Structure      13C NMR   碳谱模拟图

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

11 .     o-carboranylalanine methyl ester
C6H10B10NO2     相似度:83.3%
Tetrahedron          1995          51          1187-1196
Enantioselective synthesis of S-o-carboranylalanine via methylated bislactim ethers of 2,5-diketopiperazines
Wilhelm Karnbrock, Hans-Jürgen Musiol, Luis Moroder
Structure      13C NMR   碳谱模拟图

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

12 .     2,4-dioxo-α(RS)-amino-1-imidazolidinepropanoic acid
C6H9N3O4     相似度:83.3%
Journal of Medicinal Chemistry          1992          35          4602-4607
Quisqualic acid analogs: synthesis of .beta.-heterocyclic 2-aminopropanoic acid derivatives and their activity at a novel quisqualate-sensitized site
Nalin Subasinghe, Marvin Schulte, Robert J. Roon, James F. Koerner, Rodney L. Johnson
Structure      13C NMR   碳谱模拟图

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

13 .     trimethylcitrate
    相似度:75%
Chemical & Pharmaceutical Bulletin          2006          54(12)          1720-1721
A New Citryl Glycoside from Gastrodia elata and Its Inhibitory Activity on GABA Transaminase
Jung-Hyun CHOI and Dong-Ung LEE
Structure      13C NMR   碳谱模拟图

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

14 .     compound 2 (γ-lactone)
C7H10O5     相似度:71.4%
Journal of Natural Products          1995          Vol 58          586-589
Isolation of a Cyclic Carbonate, a γ-Butyrolactone, and a New Indole Derivative from the Marine Cyanobacterium Lyngbya majuscula
James S. Todd, William H. Gerwick
Structure      13C NMR   碳谱模拟图

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

15 .     24-methyl 3α-(methylsulfonyl)oxy,7β-acetoxy-5β-cholanoate
    相似度:71.4%
Bioorganic & Medicinal Chemistry          2010          18          6886-6895
Bile acid toxicity structure–activity relationships: Correlations between cell viability and lipophilicity in a panel of new and known bile acids using an oesophageal cell line (HET-1A)
Ruchika Sharma, Ferenc Majer, Vijaya Kumar Peta, Jun Wang, Ray Keaveney, Dermot Kelleher, Aideen Long, John F. Gilmer
Structure      13C NMR   碳谱模拟图

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

16 .     dimethyl (R)-citramalate
    相似度:71.4%
Australian Journal of Chemistry          2000          53          245-256
Pigments of Fungi. LIX. Synthesis of (1S,3S)- and (1R,3R)-Austrocortilutein and (1S,3S)-Austrocortirubin from Citramalic Acid
Melvyn Gill, Michael F. Harte and Abilio Ten
Structure      13C NMR   碳谱模拟图

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

17 .     3-carboxyethyl-3-hydroxyglutaric acid 1,5-dimethyl ester
C10H16O7     相似度:71.4%
Chinese Journal of Chemistry          2012          30          1269-1272
Chemical Constituents from the Aerial Parts of Lysimachia clethroides
Dong Liang, Yanfei Liu, Zhiyou Hao, Qingjian Zhang, Ruoyun Chen and Dequan Yu
Structure      13C NMR   碳谱模拟图

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

18 .     (-)-echinobetaine A
C8H18NO3     相似度:66.6%
Journal of Natural Products          2005          68          179-182
(−-Echinobetaine A: Isolation, Structure Elucidation,Synthesis, and SAR Studies on a New Nematocide from a Southern Australian Marine Sponge, Echinodictyum sp.
Robert J. Capon, Dat Vuong, Ernest Lacey, and Jennifer H. Gill
Structure      13C NMR   碳谱模拟图

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

19 .     1,5-dimethyl citrate
    相似度:66.6%
Acta Botanica Yunnanica          2000          22(1)          81-84
Constituents of Gastrodia elata in Guizhou
HAO Xiao-Yan, TAN Ning-Hua,ZHOU Jun
Structure      13C NMR   碳谱模拟图

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

20 .     Tetrahydropyran-4,4-dicarboxylic acid methylester
    相似度:66.6%
Molecules          2006          11          357-364
Synthesis of Novel Sterically Demanding Carbo- and Heterocyclic β-Ketoesters
Marko D. Mihovilovic, Thomas C. Fischer and Peter Stanetty
Structure      13C NMR   碳谱模拟图
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