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kuaile19856

新虫 (初入文坛)

[求助] 求助微谱数据查询

C谱数据如下:14.74,19.41,36.34,37.10,45.78,69.60,80.13,85.08,159.61,173.84.甲醇溶解,谢谢
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潘宪伟

木虫 (正式写手)

【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与,应助指数 +1
kuaile19856: 金币+10 2012-11-11 23:34:33
kuaile19856: 金币+10 2012-11-11 23:34:46
上次粘错了,实在对不住,不过你的化合物相似度挺低
1 .     compound 4
C12H18O4     相似度:60%
Phytochemistry          1988          27          469-472
Absolute structure of nepetaside,a new iridoid glucoside from Nepeta cataria
Shan Xie,Shinichi Uesato,Hiroyuki Inouye,Tetsuro Fujita,Fujio Murai,Motoko Tagawa,Tetsuro Shingu
Structure      13C NMR   碳谱模拟图

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2 .     (-)-sibirine
C11H21NO     相似度:54.5%
European Journal of Organic Chemistry          2011                   7372-7377
Enantioselective Total Syntheses of (–)-Isonitramine, (–)-Sibirine, and (+)-Nitramine by Ring-Closing Metathesis
Ganesh Pandey, C. Prasanna Kumara, Shiva Kumar Burugu and Vedavati G. Puranik
Structure      13C NMR   碳谱模拟图

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3 .     polygalacic acid
    相似度:50%
Chemical & Pharmaceutical Bulletin          1978          26          671-673
Structures of Prosapogenins from Roots of Platycodon grandiflorum determined by Carbon-13 and Hydrogen-1 Nuclear Magnetic Resonance Spectroscopy
HIROSHI ISHII,KAZUO TORI,TAKEHIKO TOZYO and YOHKO YOSHIMURA
Structure      13C NMR   碳谱模拟图

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4 .     (-)-isoiridomyrmecin
    相似度:50%
Natural Product Research          1992          1          217-220
Stereocontrolled Synthesis Of (+)-Iridomyrmecin And (-)-Isoiridomyrmecin From (-)-Limonene
Youichi Takahashi; Masakazu Tanaka; Xiao-Ming Wu; Kiyoshi Sakai
Structure      13C NMR   碳谱模拟图

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5 .     11α,17β-dihydroxyandrost-4-ene-3-one
C19H28O3     相似度:50%
Natural Product Research          2002          16          377-382
Microbial Transformation of (+)-Androsta-1,4-Diene-3,17-Dione by Cephalosporium Aphidicola
M. Iqbal ChoudHary; S. Ghulam Musharraf; Farzana Shaheen; Atta-Ur-Rahman
Structure      13C NMR   碳谱模拟图

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6 .     9-hydroxy-trans-myrtanol
    相似度:50%
Phytochemistry          1997          45          935-943
Biotransformation of (−-cis-myrtanol and (+)-trans-myrtanol by plant pathogenic fungus, Glomerella cingulata
Mitsuo Miyazawa, Yasuhiro Suzuki, Hiromu Kameoka
Structure      13C NMR   碳谱模拟图

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7 .     telephinone b
    相似度:50%
Phytochemistry          1990          29          517-519
α,βP-Unsaturated-γ-lactones from Sedum telephium roots
S.Y. Fung,J. Schripsema,R. Verpoorte
Structure      13C NMR   碳谱模拟图

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8 .     N-Ethylpiperidin-4-ylmethyl butyrate
C12H23NO2     相似度:50%
Bioorganic & Medicinal Chemistry Letters          2004          14          1927-1930
N-[18F]fluoroethylpiperidin-4-ylmethyl butyrate: a novel radiotracer for quantifying brain butyrylcholinesterase activity by positron emission tomography
Tatsuya Kikuchi, Ming-Rong Zhang, Nobuo Ikota, Kiyoshi Fukushi, Toshimitsu Okamura, Kazutoshi Suzuki, Yasushi Arano, Toshiaki Irie
Structure      13C NMR   碳谱模拟图

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9 .     Compound 5a
    相似度:50%
Magnetic Resonance in Chemistry          2005          43          599-601
1H and 13C NMR spectral assignments of isoquinuclidine-3, 5-dione derivatives
Josefina Quirante, Faïza Diaba, Xavier Vila and Josep Bonjoch
Structure      13C NMR   碳谱模拟图

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10 .     compound 4a
    相似度:50%
Tetrahedron Letters          2003          44          5263-5265
N-Bromosuccinimide-dimercaptoethane cobromination of alkenes: synthesis of β,β'-dibromodithioethers
Moufida Romdhani Younes, Mohamed Moncef Chaabouni, Ahmed Baklouti
Structure      13C NMR   碳谱模拟图

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11 .     compound 5d
C14H24N2O6     相似度:50%
Bioorganic & Medicinal Chemistry          1998          6          401-408
synthesis of new Δ2-isoxazoline derivatives and their pharmacological characterization as β-adrenergic receptor antagonists
Paola Conti, Clelia Dallanoce, Marco De Amici, Carlo De Micheli, Karl-Norbert Klotz
Structure      13C NMR   碳谱模拟图

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12 .     N,N,N',N'-Tetramethylguanidin
    相似度:50%
Zeitschrift für Naturforschung B          2010          65          873-906
Orthoamides, LXIX. Contributions to the Synthesis of N,N,N',N',N''-peralkylated Guanidines and N,N,N',N',N'',N''-persubstituted Guanidinium Salts (In German)
W. Kantlehner, J. Mezger, R. Kreß, H. Hartmann, T. Moschny, I. Tiritiris, B. Iliev, O. Scherr, G. Ziegler, B. Souley, W. Frey, I. C. Ivanov, M. G. Bogdanov, U. Jäger, G. Dospil, and T. Viefhaus
Structure      13C NMR   碳谱模拟图

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13 .     N-(2-Ethoxycarbonylethyl)-N,N',N',N'',N''-pentamethylguanidiniumiodid
C11H24IN3O2     相似度:50%
Zeitschrift für Naturforschung B          2010          65          873-906
Orthoamides, LXIX. Contributions to the Synthesis of N,N,N',N',N''-peralkylated Guanidines and N,N,N',N',N'',N''-persubstituted Guanidinium Salts (In German)
W. Kantlehner, J. Mezger, R. Kreß, H. Hartmann, T. Moschny, I. Tiritiris, B. Iliev, O. Scherr, G. Ziegler, B. Souley, W. Frey, I. C. Ivanov, M. G. Bogdanov, U. Jäger, G. Dospil, and T. Viefhaus
Structure      13C NMR   碳谱模拟图

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14 .     5,6,7,8,9,10-hexahydro-9-hydroxy-2-mercapto-5,9-methanopyrimido[4,5-b]azocin-4(3H)-one
C10H13N3O2S     相似度:50%
Heterocycles          2003          61          113-123
Synthesis and Bridgehead Reactions of 9-Substituted 5,6,7,8,9,10-Hexahydro-5,9-Methanopyrimido[4,5-b]azocin-4(3H)-ones
Edward C. Taylor* and Beena Bhatia
Structure      13C NMR   碳谱模拟图

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

15 .     (1S,2S,6S)-6-exo-hydroxyfenchol
    相似度:50%
Tetrahedron          2004          60          3091-3096
Biotransformation of (+)-(1R, 2S)-fenchol by the larvae of common cutworm (Spodoptera litura)
Mitsuo Miyazawa, Yohei Miyamoto
Structure      13C NMR   碳谱模拟图

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

16 .     5-hydroxy-1,8,8-trimethyl-2-oxabicyclo[3.3.0]octan-3-one
    相似度:50%
Tetrahedron          1994          50          10339-10344
Lactones 1. Hydroxylation of dihydro-β-campholenolactone by Fusarium culmorum
Ewa Nobilec, Miroslaw Aniol, Czeslaw Wawrzeńczyk
Structure      13C NMR   碳谱模拟图

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

17 .     (±)-isoiridomyrmecin
C10H16O2     相似度:50%
Tetrahedron          2011          67          9909-9921
Scope and applications of second generation palladium-catalyzed cycloalkenylation. Stereoselective total syntheses of isoiridomyrmecin, isodihydronepetalactone, and α-skytanthine
Kazutaka Takeda, Masahiro Toyota
Structure      13C NMR   碳谱模拟图
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