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[求助]
微谱求助,谢谢
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求助微谱数据查询
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求助微谱数据库查询一个化合物~急~!谢谢
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求助通过微谱查询化合物结构
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[求助]哪位好人学校可以使用微谱数据库,帮我检索几个化合物的母核。谢谢!
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audreygc
铁杆木虫 (正式写手)
- 应助: 236 (大学生)
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【答案】应助回帖
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感谢参与,应助指数 +1
jiangchunyong: 金币+1, 谢谢 2012-11-22 20:11:59
感谢参与,应助指数 +1
jiangchunyong: 金币+1, 谢谢 2012-11-22 20:11:59
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查询结果:共查到46个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . 6-Nitro-8-phenyloctan-3-one C14H19NO3 相似度:58.3% Tetrahedron 2012 68 5852-5856 Base-free conjugate addition of aliphatic nitro compounds to enones in BmimNTf2: a recyclable synthesis of γ-nitro ketones Raffaella Mancuso, Alessandro Palmieri, Roberto Ballini, Bartolo Gabriele Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . (S)-4-benzylpyrrolidin-2-one C11H13NO 相似度:55.5% 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 -------------------------------------------------------------------------------- 3 . 4-Oxo-5-phenylpentanoic Acid C11H12O3 相似度:55.5% European Journal of Organic Chemistry 2012 2428-2444 Lipase-Catalyzed Kinetic Resolution of 2-Phenylethanol Derivatives and Chiral Oxa-Pictet–Spengler Reaction as the Key Steps in the Synthesis of Enantiomerically Pure Tricyclic Amines Christian Ketterer and Bernhard Wünsch Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . 1,1'-[3,3'-Disulfanediylbis(propane-3,1-diyl)]bis(3,4-diphenyl-1H-pyrrole-2,5-dione) 相似度:55.5% Tetrahedron 2012 68 5863-5881 CuCl-catalyzed radical cyclisation of N-α-perchloroacyl-ketene-N,S-acetals: a new way to prepare disubstituted maleic anhydrides Andrea Cornia, Fulvia Felluga, Vincenzo Frenna, Franco Ghelfi, Andrew F. Parsons, Mariella Pattarozzi, Fabrizio Roncaglia, Domenico Spinelli Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . 3-methyl-3-phenylbutanoic acid C11H14O2 相似度:50% Journal of Natural Products 2003 66 183-199 Synthesis and Antimitotic/Cytotoxic Activity of Hemiasterlin Analogues James A. Nieman, John E. Coleman, Debra J. Wallace, Edward Piers, Lynette Y. Lim, Michel Roberge, and Raymond J. Andersen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . 3-(3-oxocyclopent-1-enyl) propanoic acid C8H10O3 相似度:50% Natural Product Research 2009 23 1431-1435 New cyclopentenones from strain Trichoderma sp. YLF-3 Guo-Hong Li; Li-Jun Zheng; Fang-Fang Liu; Li-Zhi Dang; Lei Li; Rong Huang; Ke-Qin Zhang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . 1,4-[13C]-4-oxo-4-phenylbuttersaure 相似度:50% Helvetica Chimica Acta 1978 61 1730-1755 Die massenspektrometrische retro-Diels-Alder-Reaktion: 1, 2, 3, 4-Tetrahydroisochinolin und 1, 2, 3, 4-Tetrahydronaphthalin (Tetralin). 31. Mitteilung über massenspektrometrische Untersuchungen Rudolf Gretler, Elefteria Askitol̈, Hardy Kühne and Manfred Hesse Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . N-Butylphenylsuccinimide C14H17NO2 相似度:50% Bioorganic & Medicinal Chemistry 2011 19 2823-2834 Antifungal, cytotoxic and SAR studies of a series of N-alkyl, N-aryl and N-alkylphenyl-1,4-pyrrolediones and related compounds M. Sortino,F. Garibotto , V. Cechinel Filho,M. Gupta, R. Enriz, S. Zacchino Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . 4-benzylthio-3-methylfuroxan C10H10N2O2S 相似度:50% Journal of Heterocyclic Chemistry 2009 46 866-872 Unsymmetrically substituted furoxans. Part 19. Methyl and phenylfuroxansulfonic acids and related sulfonamides Konstantin Chegaev,Barbara Rolando,Stefano Guglielmo,Roberta Fruttero and Alberto Gasco Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . 3-benzylthio-4-methylfurazan C10H10N2OS 相似度:50% Journal of Heterocyclic Chemistry 2009 46 866-872 Unsymmetrically substituted furoxans. Part 19. Methyl and phenylfuroxansulfonic acids and related sulfonamides Konstantin Chegaev,Barbara Rolando,Stefano Guglielmo,Roberta Fruttero and Alberto Gasco Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . 3-cyano-N'-hydroxy-4-phenylbutanamidine C10H11N3O 相似度:50% Heterocycles 2008 75 1371-1383 Studies with Malononitrile Derivatives: Synthesis and Reactivity of 4-Benzylpyrazole-3, 5-diamine, 4-Benzylisoxazole-3, 5-diamine and Thiazolidin-3-phenylpropanenitrile Saleh Mohammed Al-Mousawi, Moustafa Sherief Moustafa, and Mohamed Hilmy Elnagdi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . 3,3-dimethyl-6-phenyl-3,4-dihydropyridin-2(1H)-one C13H15NO 相似度:50% Heterocycles 2005 65 9-22 The Thorpe-Ingold Effect in Glutarimide Derivatives. Part II Michal Pawlowski, Jan K. Maurin, Andrzej Leniewski, Krystyna Wojtasiewicz, and Zbigniew Czarnocki* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . compound 9d C10H11N5O 相似度:50% Heterocycles 2004 63 2605-2614 Tetrazolium N-Aminides Dietrich Moderhack* and Matthias Noreiks Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . Compound 5a 相似度:50% Bioorganic & Medicinal Chemistry Letters 2008 18 6509-6512 Synthesis and evaluation of a series of homologues of lobelane at the vesicular monoamine transporter-2 Guangrong Zheng, Linda P. Dwoskin, Agripina G. Deaciuc, Peter A. Crooks Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . 1-Benzyl-4-trifluoroacetamidomethyl-1,2,3-triazole C12H11F3N4O 相似度:50% Molecules 2010 15 3087-3120 Automated Synthesis of a 96 Product-Sized Library of Triazole Derivatives Using a Solid Phase Supported Copper Catalyst Ibtissem Jlalia, Claire Beauvineau, Sophie Beauvière, Esra Önen, Marie Aufort, Aymeric Beauvineau, Eihab Khaba, Jean Herscovici, Faouzi Meganem and Christian Girard Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . 1-[(Cyclohex-3-en-1-yl)methyl]-4-trimethylsilyl-1,2,3-triazole C12H21N3Si 相似度:50% Molecules 2010 15 3087-3120 Automated Synthesis of a 96 Product-Sized Library of Triazole Derivatives Using a Solid Phase Supported Copper Catalyst Ibtissem Jlalia, Claire Beauvineau, Sophie Beauvière, Esra Önen, Marie Aufort, Aymeric Beauvineau, Eihab Khaba, Jean Herscovici, Faouzi Meganem and Christian Girard Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 17 . (Z)-5-Methyl-5-hepten-3-one 相似度:50% Magnetic Resonance in Chemistry 2000 38 479-481 1H and 13C NMR spectroscopic analysis of a series of unsaturated hexenones and heptenones Dana C. Byrd, Kevin W. Stewart and John B. Grutzner Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 18 . compound 2a 相似度:50% Tetrahedron Letters 2002 43 1247-1251 Tributylphosphine-catalyzed Stetter reaction of N,N-dimethylacrylamide: synthesis of N,N-dimethyl-3-aroylpropionamides Ji Hyeon Gong, Yang Jin Im, Ka Young Lee, Jae Nyoung Kim Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 19 . compound 2a-D 相似度:50% Tetrahedron Letters 2002 43 1247-1251 Tributylphosphine-catalyzed Stetter reaction of N,N-dimethylacrylamide: synthesis of N,N-dimethyl-3-aroylpropionamides Ji Hyeon Gong, Yang Jin Im, Ka Young Lee, Jae Nyoung Kim Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 20 . 4-phenyl-1-butanol 相似度:50% Tetrahedron Letters 2003 44 4451-4454 Preparation of alcohols from sulfones and trialkylboranes Célia Billaud, Jean-Philippe Goddard, Thierry Le Gall, Charles Mioskowski Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 21 . 3-phenyl-propionic acid 相似度:50% Chinese Pharmaceutical Journal 2009 44 418-421 Studies on Chemical Constituents in Forsythia suspensa (Thunb.) Vahl FENG Wei-sheng, LI Ke-ke, ZHENG Xiao-ke Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 22 . (+)-(3aS,6aR)-3,3a,4,6a-tetrahydro-cyclopenta -furan-2-one 相似度:50% Bioorganic & Medicinal Chemistry 1997 5 2173-2183 Enantiomers of cis- and trans-3-(4-propyl-cyclopent-2-enyl) propyl acetate. A study on the bioactive conformation and chiral recognition of a moth sex pheromone component Anna-Lena Gustavsson, Mattias C. Larsson, Bill S. Hansson, Tommy Liljefors Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 23 . 3-(Benzylthio)propionic acid C10H11O2S 相似度:50% Zeitschrift für Naturforschung B 2007 62 1317-1323 An Improved and Green Preparation of 3-(Alkylthio)propionic Acids M. J. P. Vaismaa, S. M. Yliniemelä, and M. K. Lajunen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 24 . Tris(3,3-dimethyl-2-isobut-1-enyloxy)phenylsilan C24H38O3Si 相似度:50% Zeitschrift für Naturforschung B 2007 62 1358-1370 Synthesis of Fluorosilylenolates, Aminosilylenolates, -ethers, and Aldol Condensates (In German) T. Büschen, W. Dietz, U. Klingebiel, M. Noltemeyer, and Y. Schwerdtfeger Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 25 . (E/Z)-5-Chloro-pent-3-enoic acid dimethylamide C7H12ClNO 相似度:50% Tetrahedron 2012 68 1177-1184 Cross-metathesis of allyl halides with olefins bearing amide and ester groups Jeong In Yun, Hyoung Rae Kim, Sang Kyum Kim, Deukjoon Kim, Jongkook Lee Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 26 . compound 37m 相似度:50% Journal of the Chemical Society, Perkin Transactions 1 1991 721-726 13C chemical-shift assignments in cyclooctyl derivatives from the spectra of deuterioisotopomers. Deuterium isotope effects on chemical shifts and conformational equilibria Kerry G. Penman, William Kitching and Adam P. Wells Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 27 . compound 37o 相似度:50% Journal of the Chemical Society, Perkin Transactions 1 1991 721-726 13C chemical-shift assignments in cyclooctyl derivatives from the spectra of deuterioisotopomers. Deuterium isotope effects on chemical shifts and conformational equilibria Kerry G. Penman, William Kitching and Adam P. Wells Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 28 . cis-4-(Z)-Propenylproline hydrochloride 相似度:50% Chemistry-A European Journal 2004 10 4708-4717 Final Elucidation of the Absolute Configuration of the Signal Metabolite Hormaomycin Boris D. Zlatopolskiy, Karin Loscha, Petra Alvermann, Sergei I. Kozhushkov, Sergej V. Nikolaev, Axel Zeeck and Armin de Meijere Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 29 . 2-Phenyl-cyclohexane thiol C12H14S 相似度:50% Tetrahedron 2012 68 4320-4327 Influence of chiral thiols on the diastereoselective synthesis of γ-lactams from cyclic anhydrides Original Research Article Ashkaan Younai, James C. Fettinger, Jared T. Shaw Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 30 . 3-(Prop-1-en-2-yl)cyclopent-2-enone C8H10O 相似度:50% European Journal of Organic Chemistry 2012 2041-2053 From Planning to Optimization: Total Synthesis of Valerenic Acid and Some Bioactive Derivatives Juergen Ramharter and Johann Mulzer Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 31 . 3-bromo-N-methyl-N-phenylpropanamide C10H12BrNO 相似度:50% Bioorganic & Medicinal Chemistry 2010 18 4975-4982 Evaluation of N-substitution in 6, 7-benzomorphan compounds Lorella Pasquinucci, Orazio Prezzavento, Agostino Marrazzo, Emanuele Amata, Simone Ronsisvalle, Zafiroula Georgoussi, Danai-Dionysia Fourla, Giovanna M. Scoto, Carmela Parenti, Giuseppina Aricò, Giuseppe Ronsisvalle Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 32 . 6-[1,3]dioxolan-2-yl-4-oxo-hexanoic acid C9H14O5 相似度:50% Bioorganic & Medicinal Chemistry 2009 17 7548-7561 Synthesis and structural characterization of carboxyethylpyrrole-modified proteins: mediators of age-related macular degeneration Liang Lu, Xiaorong Gu, Li Hong, James Laird, Keeve Jaffe, Jaewoo Choi, John Crabb, Robert G. Salomon Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 33 . 4-(1-adamantyl)-1,2,3-thiadiazole C12H16N2S 相似度:50% Russian Journal of Organic Chemistry 2010 46 1214-1218 Alkali metal 2-(1-adamantyl)ethynethiolates: Synthesis and reactions with electrophilic reagents M. L. Petrov, A. A. Shchipalkin, V. A. Kuznetsov and B. N. Viktorov Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 34 . 3-[(E)-1-propenyl]-2-cyclopentenone 相似度:50% Russian Journal of Organic Chemistry 2003 39 1719-1723 Prostanoids: LXXXVIII. Chlorocyclopentenone Building Blocks in the Synthesis of Marine Prostanoids R. R. Akhmetvaleev, A. M. Karimova, F. A. Akbutina, G. A. Shavaleeva and T. A. Belogaeva, et al. Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 35 . 1,2-epithio-4-phenylbutane C10H12S 相似度:50% Russian Journal of Organic Chemistry 2002 38 1620-1623 Synthesis and Structure of Some Aryl-substituted Thiiranes M. A. Allakhverdiev, K. N. Mustafaev and V. M. Farzaliev Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 36 . 4-oxo-cyclohexyl propanoate C9H14O3 相似度:50% Tetrahedron 2012 68 2363-2373 Synthesis and NMR spectroscopic conformational analysis of esters of 4-hydroxy-cyclohexanone—the more polar the molecule the more stable the axial conformer Erich Kleinpeter, Matthias Heydenreich, Andreas Koch, Torsten Linker Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 37 . N-(acetyl) dichlorofluoromethyl phenyl sulfoximine C9H8Cl2FNO2S 相似度:50% European Journal of Organic Chemistry 2011 4862-4867 Sulfoximines as a Versatile Scaffold for Electrophilic Fluoroalkylating Reagents Céline Urban, Frédéric Cadoret, Jean-Claude Blazejewski and Emmanuel Magnier Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 38 . N-propanoylbenzamide C10H11NO2 相似度:50% European Journal of Organic Chemistry 2010 5085-5089 Metal-Free Synthesis of Imido Derivatives by Direct Oxidation of α-Amido Sulfones Fabio Martinelli, Alessandro Palmieri and Marino Petrini Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 39 . 2-benzyl-3-hydroxypropyl bromide C10H13OBr 相似度:50% European Journal of Organic Chemistry 2010 4671-4686 Optically Active N- and C-Terminal Building Blocks for the Synthesis of Peptidyl Olefin Peptidomimetics Sima Mirilashvili, Naama Chasid-Rubinstein and Amnon Albeck Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 40 . (E)-4-(phenylsulfonyl)but-3-en-1-amine 相似度:50% Journal of the American Chemical Society 2010 132 12853-12855 Michael Acceptor-Containing Coenzyme A Analogues As Inhibitors of the Atypical Coenzyme A Disulfide Reductase from Staphylococcus aureus Renier van der Westhuyzen and Erick Strauss Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 41 . 3,3-diphenylbutan-2-one C16H16O 相似度:50% Helvetica Chimica Acta 2012 95 1970-1975 A One-Pot Cross-Pinacol Coupling/Rearrangement Procedure Ulf Scheffler and Rainer Mahrwald Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 42 . (S)-(-)-2-phenylcyclohexanone 相似度:50% Chemical & Pharmaceutical Bulletin 2012 60 1442-1447 Speedy and Clean Hypervalent Iodine/Nitroxyl Radical Mediated Oxidation of Alcohols Using Recyclable Adamantane Reagent with Highly Active 2-Azaadamantane-N-oxyl Organocatalyst Toshifumi Dohi, Tohru Kamitanaka, Eisuke Mochizuki, Motoki Ito, Yasuyuki Kita Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 43 . (3-iodo-propyl)-benzene 相似度:50% Tetrahedron 2012 68 9606-9611 Unexpected conversion of alkyl azides to alkyl iodides and of aryl azides to N-tert-butyl anilines Julien Maury, Laurence Feray, Michèle P. Bertrand, Ajoy Kapat, Philippe Renaud Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 44 . trans-(2,2-diphenylcyclopropyl)methanol 相似度:50% Organic Magnetic Resonance 1972 4 53-62 13C NMR spectra of cyclopropane derivatives. Stereoisomeric substituted 2-phenylcyclopropanes O. A. Subbotin, A. S. Kozmin, Yu K. Grishin, N. M. Sergeyev and I. G. Bolesov Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 45 . benzyl dimethylcarbamate 相似度:50% Organic Magnetic Resonance 1983 21 570-572 Carbon-13 NMR study of substituted benzyl N,N-dimethylcarbamates Chisako Yamagami, Narao Takao and Yoshito Takeuchi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 46 . 4-chlorobenzyl dimethylcarbamate 相似度:50% Organic Magnetic Resonance 1983 21 570-572 Carbon-13 NMR study of substituted benzyl N,N-dimethylcarbamates Chisako Yamagami, Narao Takao and Yoshito Takeuchi Structure 13C NMR 碳谱模拟图 |
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