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myvalerie至尊木虫 (正式写手)
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[求助]
微谱数据库查询求助
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66.99,77.04,112.92,115.57,122.92,124.50,127.33,138.18,196.74 模糊查询，相似度大于50%。 |
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kaola0916
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【答案】应助回帖
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感谢参与，应助指数 +1
myvalerie: 金币+15, ★★★很有帮助, Thanks! 2012-04-27 16:12:37
感谢参与，应助指数 +1
myvalerie: 金币+15, ★★★很有帮助, Thanks! 2012-04-27 16:12:37
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查询结果：共查到53个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . 3-(Hydroxylacetyl)-indol C10H9NO2 相似度:88.8% Journal of Natural Products 1991 Vol 54 1056 Aromatic Secondary Metabolites from the Sponge Tedania ignis Rhonda L. Dillman, John H. Cardellina II. Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . 3-(hydroxylacetyl)-indole 相似度:70% Chinese Journal of Natural Medicines 2004 2 88-90 Studies on Chemical Constituents of the Marine Sponge Biemna sp. from the South China Sea YAN Xiao-Hong; HOU Hui-Xin; GUO Yue-Wei Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . 2-ethenyl-1-phenylsulfonyl-1H-pyrrole C12H11NO2S 相似度:60% Journal of Heterocyclic Chemistry 2011 48 381-388 Synthesis of vinylindoles and vinylpyrroles by the Peterson olefination or by use of the Nysted reagent Wayland E. Noland, Christopher L. Etienne and Nicholas P. Lanzatella Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . 2,3,4,6-Tetrabromo-1-methyl-1H-indole 相似度:55.5% Helvetica Chimica Acta 2007 Vol. 90 1731 Terpenes and Polybromoindoles from the Marine Red Alga Laurencia decumbens (Rhodomelaceae) Nai-Yun Ji, Xiao-Ming Li, Chuan-Ming Cui, and Bin-Gui Wang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . 1,2-bis(1H-indol-3-yl)ethane-1,2-dione C18H12N2O2 相似度:55.5% Journal of Natural Products 2002 65 595-597 1,2-Bis(1H-indol-3-yl)ethane-1,2-dione, an Indole Alkaloid from the Marine Sponge Smenospongia sp. Matthew J. McKay, Anthony R. Carroll, Ronald J. Quinn, and John N. A. Hooper Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . indole-3-carboxamide C9H8N2O 相似度:55.5% Phytochemistry 2000 53 59-69 Biotransformation of the phytoalexin camalexin by the phytopathogen Rhizoctonia solani M. Soledade C. Pedras, Abdul Q. Khan Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . 3-Indolylmethylamine 相似度:55.5% Journal of Natural Products 1993 Vol 56 731 Metabolism of the Phytoalexin Brassinin by the "Blackleg" Fungus M. Soledade, C. Pedras, Janet L. Taylor Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . 1,4-dihydro-2,3-quinoxalinedione 2-oxime C8H7N3O2 相似度:55.5% Journal of Heterocyclic Chemistry 2006 43 579-583 Synthesis of oxadiazoloquinoxaline,oxathiadiazoloquinoxaline and oxadiazolobenzothiazine derivatives Konstantina C. Fylaktakidou,Konstantinos E. Litinas,Athanasios Saragliadis,Spyros G. Adamopoulos and Demetrios N. Nicolaides Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . compound 3h 相似度:55.5% Journal of Heterocyclic Chemistry 2002 39 1219-1228 Determination of aromaticity indices of thiophene and furan by nuclear magnetic resonance spectroscopic analysis of their anilides Chang Kiu Lee, Ji Sook Yu and Young Ran Ji Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . N-methoxy-3,4-dihydroquinolin-2(1H)-one C10H11NO2 相似度:55.5% Heterocycles 2010 82 339-348 Iodoarene-Mediated Cyclization of N-Methoxy-2-arylethanesulfonamides with Oxone Yoshihide Ishiwata, Yuhsuke Suzuki, and Hideo Togo Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . 4,5'-dibromo-5-methylthio-2,2'-bithiophene C9H6Br2S3 相似度:55.5% Heterocycles 2008 76 1249-1259 Selective Halogen Dance Reactions at 5, 5'-Dibromo-2, 2'-bithiophene Roman Bobrovsky, Christian Hametner, Wolfram Kalt, and Johannes Fröhlich Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . 3,4-dihydro-2(1H)-quinolinone 相似度:55.5% Heterocycles 2004 62 757-772 Reactions of 2-, 3-, and 4-Quinolinols with Cyclohexane and Benzene in Superacids Konstantin Yu. Koltunov, G. K. Surya Prakash,* Golam Rasul, and George A. Olah* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . Benzo-naphtho[2,3-e][1,4]dioxin 相似度:55.5% Tetrahedron Letters 2004 45 1343-1346 A novel one-pot synthesis of derivatives of aryldioxins and aryldithiins Patcharee Preedasuriyachai, Porntip Charoonniyomporn, Osit Karoonnirun, Tienthong Thongpanchang, Yodhathai Thebtaranonth Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . 1H-indole-3-carboxylic acid 相似度:55.5% Chinese Journal of Medicinal Chemistry 2009 19 273-275 Chemical constituents in the leaves of Baphicacanthus cusia(Nees) Bremek. LIU Yuan, OU Yang-fu, YU Hai-yang, LI Ling, WANG Nai-li, YAO Xin-sheng Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . 6-bromoindole C8H6BrN 相似度:55.5% Tetrahedron 1999 55 935-942 Synthesis of didemnolines A-D, N9-substituted β-carboline alkaloids from the marine ascidian Didemnum sp. Robert W Schumacher, Bradley S Davidson Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . 2-(4-dimethylaminoaniline)-isothiazol-3(2H)-one C11H12N2OS 相似度:55.5% Bioorganic & Medicinal Chemistry 2009 17 467-474 Synthesis of isothiazol-3-one derivatives as inhibitors of histone acetyltransferases (HATs) Stephen Gorsuch, Vassilios Bavetsias, Martin G. Rowlands, G. Wynne Aherne, Paul Workman, Michael Jarman, Edward McDonald Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 17 . 5-chloroindole-2-carbonyl chloride C22H15ClN2O2 相似度:55.5% Molecules 2011 16 8292-8304 Antihyperlipidemic Properties of Novel N-(Benzoylphenyl)-5-substituted-1H-indole-2-carboxamides in Triton WR-1339-Induced Hyperlipidemic Rats Yusuf Al-Hiari, Ghassan Shattat, Tariq Al-Qirim, Waseem El-Huneidi, Ghassan Abu Sheikha and Suhair Hikmat Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 18 . [2-methyl-4-(1H-tetrazol-1-yl)phenyl]cyanamide 相似度:55.5% Russian Journal of Organic Chemistry 2010 46 291-297 Features of the synthesis of 1,1′-Phenylenebis(1H-tetrazoles) and their transformations in basic environment A. N. Vorob’ev, A. V. Baranovskii, P. N. Gaponic and O. A. Ivashkevich Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 19 . indole-3-carboxylic acid 相似度:55.5% Zeitschrift für Naturforschung C 2011 66 485-490 Effects of Indole Amides on Lettuce and Onion Germination and Growth T. F. Borgati and M. A. D. Boaventura Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 20 . 3,4-Diamino-4'-chlorobenzophenone C13H11ClN2O 相似度:54.5% Bioorganic & Medicinal Chemistry 2011 19 1464-1470 Practical synthesis of precursor of [N-methyl-11C]vorozole, an efficient PET tracer targeting aromatase in the brain Kayo Takahashi, Gen Yamagishi, Toshiyuki Hiramatsu, Ayako Hosoya, Kayo Onoe, Hisashi Doi,Hiroko Nagata, Yasuhiro Wada, Hirotaka Onoe, Yasuyoshi Watanabe, Takamitsu Hosoya Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 21 . 3-Hydroxy-2-naphthaldehyde C11H8O2 相似度:54.5% Tetrahedron 2012 68 179-189 Insertion of arynes into the carbon–oxygen double bond of amides and its application into the sequential reactions Eito Yoshioka, Hideto Miyabe Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 22 . bruceolline L C13H15NO2 相似度:53.8% Journal of Natural Products 2011 74 2438-2445 Indole Alkaloids and Quassinoids from the Stems of Brucea mollis Hui Chen, Jian Bai, Zhen-Feng Fang, Shi-Shan Yu, Shuang-Gang Ma, Song Xu, Yong Li, Jing Qu, Jin-Hong Ren, Li Li, Yi-Kang Si, and Xiao-Guang Chen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 23 . lynamicin C C20H11N3Cl4 相似度:50% Journal of Natural Products 2008 71(10) 1732-1737 Lynamicins A-E, Chlorinated Bisindole Pyrrole Antibiotics from a Novel Marine Actinomycete Katherine A. McArthur, Scott S. Mitchell, Ginger Tsueng, Arnold Rheingold,Donald J. White, Jennifer Grodberg, Kin S. Lam, and Barbara C. M. Potts Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 24 . 3,5,6-tribromo-2-(2'-bromophenoxy)-phenol C12H6O2Br4 相似度:50% Journal of Natural Products 1997 60 1313-1316 Four New Bioactive Polybrominated Diphenyl Ethers of the Sponge Dysidea herbacea from West Sumatra, Indonesia Dian Handayani, Ru Angelie Edrada, Peter Proksch, Victor Wray, Ludger Witte, Rob W. M. Van Soest, Andreas Kunzmann, and Soedarsono Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 25 . compound 1f 相似度:50% Chemical & Pharmaceutical Bulletin 1981 29 1501-1509 Nuclear Magnetic Resonance Studies of 2-Amino- and 2-Substituted Amino-5, 6-dihydroxy-1, 2, 3, 4-tetrahydro-1-naphthalenols MICHIO MOTOHASHI,EIJI MIZUTA and MASAO NISHIKAWA Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 26 . compound 4e 相似度:50% Chemical & Pharmaceutical Bulletin 1983 31 4172-4177 Electronic Properties of Anticonvulsant Amides. A C-13 Nuclear Magnetic Resonance Study of Phenylacetanilides CHISAKO YAMAGAMI,NARAO TAKAO and YOSHITO TAKEUCHI Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 27 . compound 7 相似度:50% Journal of Natural Products 1992 Vol 55 589 1H- and 13C-nmr Spectral Studies of Some 2,4-Dimethoxyquinolines. Inconsistencies with Montrutanine, an Alkaloid from Ruta montana Alan G. Osborne, Joanne F. Warmsley, Galya T. Dimitrova Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 28 . 7-Nitro-1-oxo-1,2-dihydroisoquinoline-4-carbonitrile C10H5N3O3 相似度:50% Bioorganic & Medicinal Chemistry 2011 19 429-439 Synthesis and biological evaluation of 7-substituted-1-(3-bromophenylamino)isoquinoline-4-carbonitriles as inhibitors of myosin light chain kinase and epidermal growth factor receptor Haridas B. Rode, Martin L. Sos, Christian Grütter, Stefanie Heynck, Jeffrey R. Simard, Daniel Rauh Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 29 . N-(1-(5-Chloro-1H-indol-3-yl)ethyl)hydroxylamine 相似度:50% Bioorganic & Medicinal Chemistry 2011 19 3204-3215 Synthesis and evaluation of 1-(1H-indol-3-yl)ethanamine derivatives as new antibacterial agents Olga N. Burchak,Emmanuelle Le Pihive, Laure Maigre, Xavier Guinchard , Pascale Bouhours ,Claude Jolivalt, Dominique Schneider , Max Maurin , Carmela Giglione , Thierry Meinnel ,Jean-Marc Paris , Jean-Noël Denis Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 30 . tryptamine 相似度:50% Chinese Journal of Marine Drugs 2010 29(1) 45-49 Alkaloids from the sea anemone Haliplanella luciae LU Ya-nan, FAN Cheng-qi, XI Dun-yu, ZHAO Si, MIAO Yu-ping Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 31 . 1-(phenylsulfonyl)-1H-indole 相似度:50% Chemical & Pharmaceutical Bulletin 2009 57 591-596 Novel Furanylarylene Arylsulfonylindolesulfonamides: Synthesis and Their Antibacterial Evaluation Chennan Ramalingan, In-Sook Lee and Young-Woo Kwak Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 32 . 3-(hydroxyacetyl)indole 相似度:50% Phytochemistry 1990 29 3697-3698 3-(Hydroxyacetyl)indole,a plant growth regulator from the oregon red alga Prionitis lanceolata Matthew Bernart,William H. Gerwick Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 33 . 2-benzyl-2H,6H-pyrrolo[3,4-e]indole-1,3-dione C17H12N2O2 相似度:50% Journal of Heterocyclic Chemistry 2009 46 1154-1176 Access to indoles via Diels-Alder reactions of 2-vinylpyrroles with maleimides Wayland E. Noland,Nicholas P. Lanzatella,Lakshmanan Venkatraman,Nicholas F. Anderson and Glen C. Gullickson Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 34 . compound 6 相似度:50% Journal of Heterocyclic Chemistry 2005 42 867-875 A study of substituent effect on 1H and 13C NMR spectra of mono,di and poly substituted carbazoles Sergio M. Bonesi,Maria A. Ponce and Rosa Erra-Balsells Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 35 . N-(thien-3-yl-methyloxymethyl)phthalimide C14H11NO3S 相似度:50% Journal of Heterocyclic Chemistry 2003 40 499-505 Evaluation of N-hydroxymethylphthalimide in alkaline medium: Novel entry to the tricyclic [1,3]oxazepine core via an intramolecular π and O-cationic cyclization Armelle Cul,Anthony Pesquet,Adam Daïch,Abderrahim Chihab-Eddine and Štefan Marchalín Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 36 . 2-ethoxy-bis[1,2,4]triazolo[1,5-a:4',3'-c]quinazoline C12H10N6O 相似度:50% Heterocycles 2010 81 1843-1859 Novel Synthesis of 2-Alkoxy(Aralkoxy)-5-chloro[1,2,4]triazolo[1,5-a]quinazolines and Their Derivatives Rashad Al-Salahi and Detlef Geffken Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 37 . 1,4-(3,3′-diindolyl)-1,4-dioxobutane C20H16N2O2 相似度:50% Heterocycles 2004 63 2371-2377 Effect of Sodium Naphthalenide, a Key Set Reagent, on 3-Substituted Indoles Avijit Banerji*, Debasish Bandyopadhyay, and Bidyut Basak Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 38 . Compound 2 相似度:50% Bioorganic & Medicinal Chemistry Letters 2003 13 1725-1728 Synthesis of fluorinated 1-(3-Morpholin-4-yl-phenyl)-Ethylamines Yong-Jin Wu, Huan He, Li-Qiang Sun, Dedong Wu, Qi Gao, Hui-Yin Li Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 39 . Compound 7 相似度:50% Bioorganic & Medicinal Chemistry Letters 2003 13 1725-1728 Synthesis of fluorinated 1-(3-Morpholin-4-yl-phenyl)-Ethylamines Yong-Jin Wu, Huan He, Li-Qiang Sun, Dedong Wu, Qi Gao, Hui-Yin Li Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 40 . 4,4'-dihydroxy-3,3'-dimethoxy-b,b'-bicinnamic acid C20H18O8 相似度:50% Bioorganic & Medicinal Chemistry Letters 2010 20 5095-5098 Concise synthesis of Cannabisin G Dawei Li, Wenling Li, Qian Wang, Zhaoqi Yang, Zijie Hou Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 41 . 3-indoleacetic acid 相似度:50% Chemistry of Natural Compounds 2010 46 763-766 Indole alkaloids from the roots of Isatis ingigotica and their antiherpes simplex virus type 2 (HSV-2) activity in vitro Dong-Dong Sun, Wei-wei Dong, Xiang Li and Han-Qing Zhang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 42 . compound 5a C14H12N4 相似度:50% Tetrahedron Letters 2004 45 6129-6132 Regiospecific solid-phase synthesis of substituted 1,2,3-triazoles Makam S Raghavendra, Yulin Lam Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 43 . 1,4-(3,3'-Diindolyl)-1,4-dioxobutane 相似度:50% Tetrahedron Letters 2005 46 7033-7035 Effect of sodium naphthalenide, a key SET reagent, on trifluoroacetyl derivatives Avijit Banerji, Debasish Bandyopadhyay, Bidyut Basak, Kumar R. Sur, Jyoti N. Paul, Julie Banerji, Asima Chatterjee Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 44 . 2-(2-azulenyl)-1H-benzimidazole C17H12N2 相似度:50% Heterocycles 2003 61 339-348 Synthesis of Azulenylheterocyclic Compounds Using 2-(2-Azulenyl)ethynyltriphenylphosphonium Bromide Shunji Ito, Shiro Moriyama, Masashi Nakashima, Masataka Watanabe, Takahiro Kubo, Masafumi Yasunami, Kunihide Fujimori, and Noboru Morita* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 45 . 2H-3,1-benzoxaz ine-1-(4H)-acetonitri le C10H10N2O 相似度:50% Heterocycles 2002 57 1599-1614 A New General Route to Novel Azomethine Ylides for Cycloaddition Reactions François-Xavier Lery, Nicole Kunesch, Pascal George, and Henri-Philippe Husson* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 46 . 5-isopropyloxy-2,2'-bithiophene C11H12OS2 相似度:50% Heterocycles 2001 55 1487-1498 A Combination of Friedel-Crafts and Lawesson Reactions to 5-Substituted 2,2'-Bithiophenes M. Manuela M. Raposo* and Gilbert Kirsch Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 47 . (1H-indol-3-yl)carbonyl nitrile 相似度:50% Tetrahedron 2002 58 2813-2819 Synthesis of the marine alkaloids rhopaladins A, B, C and D Tomasz Janosik, Ann-Louise Johnson, Jan Bergman Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 48 . 3-indolylglyoxylic acid C10H7O3N 相似度:50% Tetrahedron 1997 53 2055-2060 Alboinon, an oxadiazinone alkaloid from the ascidian Dendrodoa grossularia Tanja Bergmann, Dirk Schories, Bert Steffan Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 49 . 2-(2-chloro-5-nitrophenyl)-1H-benzo[d]imidazole C13H8ClN3O2 相似度:50% Bioorganic & Medicinal Chemistry 2009 17 4943-4954 Synthesis and biological evaluation of SANT-2 and analogues as inhibitors of the hedgehog signaling pathway Anita Büttner, Katrin Seifert, Thomas Cottin, Vasiliki Sarli, Lito Tzagkaroulaki, Stefan Scholz, Athanassios Giannis Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 50 . 2-benzylsulfinyl-1H-benzimidazole 相似度:50% Russian Journal of Organic Chemistry 2011 47 124-130 Oxidation of polyfunctional sulfides with chlorine dioxide I. V. Loginova, K. S. Rodygin, S. A. Rubtsova, P. A. Slepukhin and A. V. Kuchin, et al. Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 51 . 1,4-bis[3-(2,2,2-trichloro-1-trifluoromethylsul-fonylaminoethyl)-1H-pyrrol-1-ylmethyl]benzene 相似度:50% Russian Journal of Organic Chemistry 2009 45 1365-1374 C-amidoalkylation of pyrroles with N-trifluoromethylsulfonyl and N-arylsulfonyl polychloroaldehyde imines E. V. Kondrashov, E. V. Rudyakova, G. N. Rozentsveig, I. B. Rozentsveig and K. A. Chernyshev, et al. Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 52 . methyl 2-(4-methoxyphenyl)imidazole-5-carboxylate C12H12N2O3 相似度:50% Tetrahedron 2012 68 3123-3128 Highly efficient oxidation of 2-imidazoline-5-carboxylic derivatives to imidazole-5-carboxylic derivatives by dioxygen Yue Huang, Xiaodong Zu, Fan Wu, Jinyi Xu, Xiaoming Wu, Hequan Yao Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 53 . 2-(6-Bromoindol-3-yl)glyoxylic acid C10H6BrNO3 相似度:50% Journal of Natural Products 2011 74 888-892 Didemnidines A and B, Indole Spermidine Alkaloids from the New Zealand Ascidian Didemnum sp. Rhys Finlayson, A. Norrie Pearce, Michael J. Page, Marcel Kaiser, Marie-Lise Bourguet-Kondracki, Jacquie L. Harper, Victoria L. Webb, and Brent R. Copp Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- |
2楼2012-04-27 12:31:24
