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devilpanda

金虫 (小有名气)

[求助] 微谱求助

9.82, 19.28, 19.79, 36.36, 79.90
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jasminelw

铁杆木虫 (正式写手)

引用回帖:
6楼: Originally posted by springbow at 2013-09-23 10:48:04
这个怎么查的?谢谢...

有一个专门的数据库,按要求输入碳的信号值就行了。。。
7楼2013-09-23 16:47:56
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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
devilpanda: 金币+25, ★★★★★最佳答案 2013-09-22 10:46:12
查询结果:共查到101个化合物(查询结果仅供参考)
1 .     17β-hydroxyandrosta-1,4-diene-3-one
C19H26O2     相似度:80%
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
2 .     (E)-2,2'-Azobis-(2-methyl-cylopentan-1-one) N,N'-dioxide
C12H18N2O4     相似度:66.6%
Archiv der Pharmazie          1998          331          104-110
Azodioxides Activated by Electron Acceptors in Geminal or Vicinal Position
Klaus Rehse and Martin Herpel
Structure      13C NMR   碳谱模拟图
3 .     (3RS,5RS,6RS)-3,5,6-trimethyltetrahydropyran-2H-one
C8H14O2     相似度:62.5%
Journal of Chemical Ecology          1999          25          355-368
Relative Configuration of a δ-Lactone Isolated from Mandibular Gland Secretion of Calomyrmex sp. Males
Ronaldo A. Pilli, Maria Alice Böckelmann and Andre Del Corso
Structure      13C NMR   碳谱模拟图
4 .     (3RS,5RS,6RS)-3,5,6-Trimethyltetrahydropyran-2H-one
C8H14O2     相似度:62.5%
Journal of Chemical Ecology          1999          25          355-368
Relative Configuration of a δ-Lactone Isolated from Mandibular Gland Secretion of Calomyrmex sp. Males
Ronaldo A. Pilli, Maria Alice Böckelmann, Andre Del Corso
Structure      13C NMR   碳谱模拟图
5 .     3,7-Di-(hexane-1,6-diyl)-perhydro[1,2,4]triazolo[1,2-a][1,2,4]triazole-1,5-dione
    相似度:60%
Molecules          2006          11          34-42
Criss-cross Cycloadditions on Ketazines Derived from Alicyclic Ketones
Jiri Verner and Milan Potacek
Structure      13C NMR   碳谱模拟图
6 .     (−-(1R,2R)-1-amino-2-methylcyclopropanephosphonic acid
C4H10NO4P     相似度:60%
Tetrahedron Letters          2000          41          197-199
Asymmetric synthesis of a phosphonic analogue of (−-allo-norcoronamic acid
Alain Hercouet, Maurice Le Corre, Bertrand Carboni
Structure      13C NMR   碳谱模拟图
7 .     compound 9a
C5H9N5O     相似度:60%
Heterocycles          2009          78          2509-2522
Tetrazolium N-Aminides: Complementary Studies on Synthesis and Properties
Dietrich Moderhack and Matthias Noreiks
Structure      13C NMR   碳谱模拟图
8 .     compound 10a
C5H9N5O     相似度:60%
Heterocycles          2009          78          2509-2522
Tetrazolium N-Aminides: Complementary Studies on Synthesis and Properties
Dietrich Moderhack and Matthias Noreiks
Structure      13C NMR   碳谱模拟图
9 .     compound 14a
C6H12N5OI     相似度:60%
Heterocycles          2009          78          2509-2522
Tetrazolium N-Aminides: Complementary Studies on Synthesis and Properties
Dietrich Moderhack and Matthias Noreiks
Structure      13C NMR   碳谱模拟图
10 .     compound 16a
C6H12N5OI     相似度:60%
Heterocycles          2009          78          2509-2522
Tetrazolium N-Aminides: Complementary Studies on Synthesis and Properties
Dietrich Moderhack and Matthias Noreiks
Structure      13C NMR   碳谱模拟图
11 .     1-[(Prop-1-ylamino)ethyl] 1,1-bisphosphonic acid
C5H15NO6P2     相似度:60%
Bioorganic & Medicinal Chemistry          2008          16          3283-3290
Synthesis and biological evaluation of 2-alkylaminoethyl-1,1-bisphosphonic acids against Trypanosoma cruzi and Toxoplasma gondii targeting farnesyl diphosphate synthase
Sergio H. Szajnman, Guadalupe E. Garcı′a Liñares, Zhu-Hong Li, Cuiying Jiang, Melina Galizzi, Esteban J. Bontempi, Marcela Ferella, Silvia N.J. Moreno, Roberto Docampo, Juan B. Rodriguez
Structure      13C NMR   碳谱模拟图
12 .     compound 21'
    相似度:60%
Zeitschrift für Naturforschung B          2007          62          1174-1182
Triethylborane: An "Old" Reagent with New Functions. 1,2-Hydroboration
B. Wrackmeyer, E. Khan, S. Bayer, and K. Shahid
Structure      13C NMR   碳谱模拟图
13 .     compound 22
    相似度:60%
Zeitschrift für Naturforschung B          2007          62          1174-1182
Triethylborane: An "Old" Reagent with New Functions. 1,2-Hydroboration
B. Wrackmeyer, E. Khan, S. Bayer, and K. Shahid
Structure      13C NMR   碳谱模拟图
14 .     compound 24'
    相似度:60%
Zeitschrift für Naturforschung B          2007          62          1174-1182
Triethylborane: An "Old" Reagent with New Functions. 1,2-Hydroboration
B. Wrackmeyer, E. Khan, S. Bayer, and K. Shahid
Structure      13C NMR   碳谱模拟图
15 .     cis-2,6-dimethyl-2H,6H-1,3,5-thiaselenazin-4-amine hydrochloride
C5H11ClN2SSe     相似度:60%
Russian Journal of Organic Chemistry          2007          43          1087
Reactionofdivinylsulfidewithselenourea
S. V. Amosova, K. A. Volkova, M. V. Penzik, A. S. Nakhmanovich and A. I. Albanov, et al.
Structure      13C NMR   碳谱模拟图
16 .     endo-6-syn-7-diiodobicyclo[3.1.1]heptane
C7H10I2     相似度:60%
Russian Journal of Organic Chemistry          2002          38          803-809
Iodination of Tricyclo[4.1.0.02,7]heptane in the Presence of External Nucleophiles
V. A. Vasin, A. V. Semenov and V. V. Razin
Structure      13C NMR   碳谱模拟图
17 .     (R)-1-nitropentan-2-ol
    相似度:60%
European Journal of Organic Chemistry          2011                   4892-4898
Efficient Asymmetric Copper(I)-Catalyzed Henry Reaction Using Chiral N-Alkyl-C1-tetrahydro-1,1′-bisisoquinolines
Yao Qiong ji, Gao Qi and Zaher M. A. Judeh
Structure      13C NMR   碳谱模拟图
18 .     (R)-3-methyl-1-nitrobutan-2-ol
    相似度:60%
European Journal of Organic Chemistry          2011                   4892-4898
Efficient Asymmetric Copper(I)-Catalyzed Henry Reaction Using Chiral N-Alkyl-C1-tetrahydro-1,1′-bisisoquinolines
Yao Qiong ji, Gao Qi and Zaher M. A. Judeh
Structure      13C NMR   碳谱模拟图
19 .     (R)-3-iodo-2-methyl-1-[[(trifluoromethyl)sulfonyl]oxy]propane
    相似度:60%
Journal of Medicinal Chemistry          1990          33          1482-1490
N-(3-[18F]Fluoropropyl)-N-nordiprenorphine: synthesis and characterization of a new agent for imaging opioid receptors with positron emission tomography
Paul L. Chesis, Dah Ren Hwang, Michael J. Welch
Structure      13C NMR   碳谱模拟图
20 .     (R)-1-bromo-2-methylbutane
    相似度:60%
Journal of Chemical Ecology          2007          33          1774-1786
Sex Pheromone Components of Indian Gypsy Moth, Lymantria obfuscata
Regine Gries, Paul W. Schaefer, Roger Hahn, Grigori Khaskin, Gujjandadu Ramaseshiah, Balbir Singh, Gagandeep K. Hehar, Gerhard Gries
Structure      13C NMR   碳谱模拟图
21 .     2,3-dimethylbut-1-ene
    相似度:60%
Organic Magnetic Resonance          1976          8          426-431
13C chemical shifts of some model olefins
P. A. Couperus, A. D. H. Clague and J. P. C. M. van Dongen
Structure      13C NMR   碳谱模拟图
22 .     2-isopropylaziridine
    相似度:60%
Organic Magnetic Resonance          1976          8          79-89
13C NMR study of N-unsubstituted aziridines: I—steric effects, pseudoconjugation
P. Mison, R. Chaabouni, Y. Diab, R. Martino, A. Lopez, A. Lattes, F. W. Wehrli and T. Wirthlin
Structure      13C NMR   碳谱模拟图
23 .     (1R,3S,4R)-Spiro[2,4]pentane-1,4-diyldimethanol
C7H12O2     相似度:60%
European Journal of Organic Chemistry          2012                   1530-1545
A Novel Type of Chiral Triangulane-Based Diphosphane Ligands for Transition Metals
Alexander F. Khlebnikov, Sergei I. Kozhushkov, Dmitry S. Yufit, Heiko Schill, Michael Reggelin, Volker Spohr and Armin de Meijere
Structure      13C NMR   碳谱模拟图
24 .     1R(S),2R(S),3R,4S(R),5S(R)-3-Methyl-8-oxabicyclo[3.2.1]oct-6-ene-2,4-diol
C8O12O3     相似度:60%
Tetrahedron          2012          68          5785-5792
Stereoselective synthesis of highly substituted 8-oxabicyclo[3.2.1]octanes and 2,7-dioxatricyclo[4.2.1.03,8]nonanes
Dmitry A. Khlevin, Sergey E. Sosonyuk, Marina V. Proskurnina, Nikolay S. Zefirov
Structure      13C NMR   碳谱模拟图
25 .     Methyl 1-(Methylsulfinyl)propyl Disulfide
C5H12S3O     相似度:60%
Journal of Agricultural and Food Chemistry          1997          45          4414-4422
Allium Chemistry:  Synthesis of 1-[Alk(en)ylsulfinyl]propyl Alk(en)yl Disulfides (Cepaenes), Antithrombotic Flavorants from Homogenates of Onion (Allium cepa)
Eric Block, Harsh Gulati, David Putman, Deyou Sha, Niannian You, and Shu-Hai Zhao
Structure      13C NMR   碳谱模拟图
26 .     [1-13C]-5-Methylhexanenitrile
    相似度:60%
Journal of the American Chemical Society          1992          114          663-668
Biosynthesis of virginiae butanolide A, a butyrolactone autoregulator from Streptomyces
Shohei Sakuda, Ayako Higashi, Sumiko Tanaka, Takuya Nihira, Yasuhiro Yamada
Structure      13C NMR   碳谱模拟图
27 .     3,3-Dimethyl-γ-sultine
    相似度:60%
Flavour and Fragrance Journal          2002          17          425-431
γ-Sultines: a new class of flavour compounds
S. Yolka, E. Dunach, M. Loiseau, L. Lizzani-Cuvelier, R. Fellous, S. Rochard, C. Schippa and G. George
Structure      13C NMR   碳谱模拟图
28 .     Sodium O-(1-Propylbutyl) Carbonodithioate
C8H15OS2     相似度:60%
Helvetica Chimica Acta          2013          96          889-896
Unexpected Ritter Reaction During Acid-Promoted 1,3-Dithiol-2-one Formation
Frédéric Dumur and Cédric R. Mayer
Structure      13C NMR   碳谱模拟图
29 .     17β-hydroxyandrosta-1,4-dien-3-one
C19H26O2     相似度:57.1%
Natural Product Research          2004          18          529-535
Biotransformation of (+)-androst-4-ene-3,17-dione
M. Iqbal Choudhary; Sadia Sultan; Mahmmud Tareq Hassan Khan; Amsha Yasin; Farzana Shaheen; Atta-Ur-Rahman
Structure      13C NMR   碳谱模拟图
30 .     (R)-4-isopropylpyrrolidin-2-one
C7H13NO     相似度:57.1%
Heterocycles          2005          66          385-403
Asymmetric Synthesis of β-Substituted γ-Lactams Employing the SAMP-/RAMP-Hydrazone Methodology. Application to the Synthesis of (R)-(-)-Baclofen
Dieter Enders* and Oliver Niemeier
Structure      13C NMR   碳谱模拟图
31 .     trans-2,3-dimethyl-tetrahydropyran
    相似度:57.1%
Organic Magnetic Resonance          1983          21          94-107
Carbon-13 NMR spectra of saturated heterocycles: XI—Tetrahydropyrans (oxanes)
Ernest L. Eliel, Muthiah Manoharan, K. Michal Pietrusiewicz and Karl D. Hargrave
Structure      13C NMR   碳谱模拟图
32 .     1-(Methylsulfinyl)propyl (E)-1-Propenyl Disulfide
C7H14S3O     相似度:57.1%
Journal of Agricultural and Food Chemistry          1997          45          4414-4422
Allium Chemistry:  Synthesis of 1-[Alk(en)ylsulfinyl]propyl Alk(en)yl Disulfides (Cepaenes), Antithrombotic Flavorants from Homogenates of Onion (Allium cepa)
Eric Block, Harsh Gulati, David Putman, Deyou Sha, Niannian You, and Shu-Hai Zhao
Structure      13C NMR   碳谱模拟图
33 .     2,2,3,4-tetramethyl-3-pentanol
    相似度:57.1%
Journal of Agricultural and Food Chemistry          1996          44          2806-2809
Tertiary Alcohols with Earthy Odor
Elio Napolitano, Elena Giovani, Nello Ceccarelli, and Paolo Pelosi
Structure      13C NMR   碳谱模拟图
34 .     1-(4-methyl-5-oxotetrahydrofuran-3-yl)ethyl acetate
C9H14O4     相似度:55.5%
Food Chemistry          2011          129          92-99
Extract of the mushroom Mycoleptodonoides aitchisonii induces a series of anti-oxidative and phase II detoxifying enzymes through activation of the transcription factor Nrf2
Takeshi Kokubo, Yoshimasa Taniguchi, Masaya Kanayama, Masako Shimura, Yutaka Konishi, Hirokazu Kawagishi, Masayuki Yamamoto, Kazutoshi Shindo, Aruto Yoshida
Structure      13C NMR   碳谱模拟图
35 .     (+)-(3S*,4R*,5S*)-trihydroxysabinane
C10H18O3     相似度:50%
Journal of Natural Products          2004          67          1705-1710
Polyol Monoterpenes and Sesquiterpene Lactones from the Pacific Northwest Plant Artemisia suksdorfii
Ahmed, Safaa A. El-Moghazy, Mohamed A. El-Shanawany, Hoda F.Abdel-Ghani, Joe Karchesy, George Sturtz, Kent Dalley, and Paul W. Par
Structure      13C NMR   碳谱模拟图
36 .     MKN-004D
C13H22O3     相似度:50%
Journal of Natural Products          2001          64          664-667
New Lactone-Containing Metabolites from a Marine-Derived Bacterium of the Genus Streptomyces
Ki Woong Cho, Hyi-Seung Lee, Jung-Rae Rho, Tae Sik Kim, Sang Jun Mo, and Jongheon Shin
Structure      13C NMR   碳谱模拟图
37 .     compound 3
    相似度:50%
Journal of Natural Products          1998          61          282-284
Haliclorensin, a Novel Diamino Alkaloid from the Marine Sponge Haliclona tulearensis
Ganit Koren-Goldshlager, Yoel Kashman, and Michael Schleyer
Structure      13C NMR   碳谱模拟图
38 .     3,13-di-O-(S-methyl)thiocarbonylmesaconitine
    相似度:50%
Chemical & Pharmaceutical Bulletin          1991          39          2803-2806
Studies on Aconitum Species. XV. Deoxygenation Reaction of Aconitine Type Alkaloids
Takao MORI,Mitsuo MURAYAMA,Hideo BANDO and Norio KAWAHARA
Structure      13C NMR   碳谱模拟图
39 .     3,13-di-O-(S-methyl)thiocarbonylaconitine
    相似度:50%
Chemical & Pharmaceutical Bulletin          1991          39          2803-2806
Studies on Aconitum Species. XV. Deoxygenation Reaction of Aconitine Type Alkaloids
Takao MORI,Mitsuo MURAYAMA,Hideo BANDO and Norio KAWAHARA
Structure      13C NMR   碳谱模拟图
40 .     3,13-di-O-(S-methyl)thiocarbonyljesaconitine
    相似度:50%
Chemical & Pharmaceutical Bulletin          1991          39          2803-2806
Studies on Aconitum Species. XV. Deoxygenation Reaction of Aconitine Type Alkaloids
Takao MORI,Mitsuo MURAYAMA,Hideo BANDO and Norio KAWAHARA
Structure      13C NMR   碳谱模拟图
2楼2013-09-22 09:50:33
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tgl_andy

金虫 (小有名气)

这么长的。

[ 发自小木虫客户端 ]
如果你觉得自己很幸福了,恭喜你,你成功了!
3楼2013-09-22 09:57:47
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devilpanda

金虫 (小有名气)

引用回帖:
2楼: Originally posted by jasminelw at 2013-09-22 09:50:33
查询结果:共查到101个化合物(查询结果仅供参考)
1 .     17β-hydroxyandrosta-1,4-diene-3-one
C19H26O2     相似度:80%
Natural Product Research          2002          16          377-382
Microbial ...

你能不能下到第一篇文献啊,我找不到  谢谢啊
4楼2013-09-22 10:54:30
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