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[求助]
求微谱检索数据
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13C NMR (101 MHz, CDCl3) δ = 30.46,48.72,58.50,110.07,119.80,124.40,126.57 ,127.50 ,128.60 ,129.14 ,132.98,139.00, 204.63, [ Last edited by 晕月山江 on 2012-4-19 at 00:05 ] |
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kaola0916
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晕月山江: 金币+10, ★有帮助 2012-04-19 09:05:07
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晕月山江: 金币+10, ★有帮助 2012-04-19 09:05:07
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查询结果：共查到609个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . 4-anilino-1-(2-phenylethyl)piperidine-4-carboxamide 相似度:69.2% Chemical & Pharmaceutical Bulletin 2009 57 1421-1424 A Facile Method for Preparation of [2H3]-Sufentanil and Its Metabolites Sankareswaran Srimurugan, Kaliyappan Murugan and Chinpiao Chen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . 2-cyanomethylthio-N-methyl-3-phenylindole C17H14N2S 相似度:69.2% Journal of Heterocyclic Chemistry 2001 38 105-108 Synthesis of indole and indolenine derivatives starting from indoline-2-thiones Takehiko Nishio, Osamu Saku and Hiroshi Yamamoto Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . 2-[(benzotriazol-1-yl)me-thyl]phenyl methyltriazene C14H14N6 相似度:69.2% Journal of Heterocyclic Chemistry 2010 47 98-111 n-Butyllithium-mediated reactions of 1-(2-azidoarylmethyl)- 1H-benzotriazoles with alkyl halides Taehoon Kim and Kyongtae Kim Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . 1-[1-(2-azi-dophenyl)-4-pentenyl]-1H-benzotriazole C17H16N6 相似度:66.6% Journal of Heterocyclic Chemistry 2010 47 98-111 n-Butyllithium-mediated reactions of 1-(2-azidoarylmethyl)- 1H-benzotriazoles with alkyl halides Taehoon Kim and Kyongtae Kim Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . compound 7a C15H17NS 相似度:64.2% Journal of Heterocyclic Chemistry 2005 42 201-207 Intramolecular photoreactions of thiohomophthalimides with an alkenyl group in their N-Side chain. Regioselective synthesis of heterocycle-fused isoquinoline derivatives through [2+2] photocycloaddition Haruko Takechi,Hajime Takahashi and Minoru Machida Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . 4-[(1-benzyl-1H-imidazol-5-yl)methyl]benzonitrile C18H15N3 相似度:64.2% Journal of Heterocyclic Chemistry 2003 40 229-241 Preparation of a clinically investigated ras farnesyl transferase inhibitor Peter E. Maligres,Marjorie S. Waters,Steven A. Weissman,J. Christopher McWilliams,Stephanie Lewis,Jennifer Cowen,Robert A. Reamer,R. P. Volante,Paul J. Reider and David Askin Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . 1-[(2-azido-3-methyl)phenylmethyl]-1H-benzotriazole C14H12N6 相似度:64.2% Journal of Heterocyclic Chemistry 2010 47 98-111 n-Butyllithium-mediated reactions of 1-(2-azidoarylmethyl)- 1H-benzotriazoles with alkyl halides Taehoon Kim and Kyongtae Kim Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . 9,9-bis-(5-phenylpyrrol-2-yl)fluorene C33H24N2 相似度:64.2% Heterocycles 2006 68 1121-1138 Facile Synthesis of 2-Arylpyrroles from 4-Oxo-butanoic Acids and Their Use in the Preparation of Bis(pyrrolyl)methanes David J. Jones and Vernon C. Gibson* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . ethyl 1-benzyl-2,3,6,7-tetrahydro-1H-azepine-2-carboxylate C16H21NO2 相似度:64.2% Russian Journal of Organic Chemistry 2010 46 1277-1281 Synthesis of non-natural cyclic amino acids from available unsaturated tertiary amines I. D. Titanyuk and I. P. Beletskaya Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . 1,2-bis-(1-phenyl-1H-pyrrol-2-yl)-ethane-1,2-dione C20H16N2O2 相似度:61.5% Molecules 1999 4 151-158 Synthesis of N-Phenylpyrrole Carboximides Dieter Hubmann, Christoph Liechti, Uwe Trinks, Peter Traxler and Urs Séquin Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . N-Benzyl-N-(1-(5-fluoro-1H-indol-3-yl)ethyl)hydroxylamine 相似度:61.5% 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 -------------------------------------------------------------------------------- 12 . 4-(4-Methoxy-1-(phenylsulfonyl)-1H-pyrrol-2-yl)-4-oxobutanal C15H15NO5S 相似度:61.5% Canadian Journal of Chemistry 2008 86 213-218 Prodigiosin synthesis with electron rich 2,2'-bipyrroles Benoit Jolicoeur and William D. Lubell Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . (Anti)2-[Hydroxy-(2-chloro-phenyl)-methyl]-cyclohexanone 相似度:61.5% Canadian Journal of Chemistry 2007 85 208-213 Asymmetric organocatalytic direct aldol reactions of cyclohexanone with aldehydes in brine Wen-Ping Huang, Jia-Rong Chen, Xin-Yong Li, Yi-Ju Cao, and Wen-Jing Xiao Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . 1-benzyl-4-phenylamino-4-(methoxymethyl)piperidine 相似度:61.5% Chemical & Pharmaceutical Bulletin 2009 57 1421-1424 A Facile Method for Preparation of [2H3]-Sufentanil and Its Metabolites Sankareswaran Srimurugan, Kaliyappan Murugan and Chinpiao Chen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . compound [2H3]-6 相似度:61.5% Chemical & Pharmaceutical Bulletin 2009 57 1421-1424 A Facile Method for Preparation of [2H3]-Sufentanil and Its Metabolites Sankareswaran Srimurugan, Kaliyappan Murugan and Chinpiao Chen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . compound 7 C13H9NO 相似度:61.5% Journal of Heterocyclic Chemistry 2009 46 988-992 Reinvestigation of alternative method for the preparation of dibenz[b,f][1,4]oxazepine Hossein Fakhraian and Yaser Nafary Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 17 . N-methyl-2-benzylaniline C14H15N 相似度:61.5% Journal of Heterocyclic Chemistry 2008 45 837-843 Thermal reactions of N-alkyl-2-benzylaniline and N-alkyl-N'-phenyl-o-phenylenediamine: An unusual route to 2-phenylindole and 2-phenylbenzimidazole Evelyn Cuevas Creencia,Kei Taguchi and Takaaki Horaguchi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 18 . dibenz[b,f][1,4]oxazepine 相似度:61.5% Journal of Heterocyclic Chemistry 2008 45 1469-1471 Improved etherification procedure for the preparation of dibenz[b,f][1,4]oxazepine H. Fakhraian,Y. Nafary,A. Yarahmadi and H. Hadj-Ghanbary Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 19 . 1,3-diphenyl-4H-pyrazol-5-thione C15H12N2S 相似度:61.5% Journal of Heterocyclic Chemistry 2007 44 49-53 Synthesis and antimicrobial activity of novel spirocompounds with pyrazolone and pyrazolthione moiety Madhukar S. Chande,Pravin A. Barve and Vijay Suryanarayan Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 20 . 1-methoxy-4-(2'-thienyl)-phthalazine C13H10N2O 相似度:61.5% Journal of Heterocyclic Chemistry 2005 42 1245-1251 A Convenient access to thienyl-substituted phthalazines M. Manuela M. Raposo,Ana M. B. A. Sampaio and G. Kirsch Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 21 . compound 1d 相似度:61.5% Journal of Heterocyclic Chemistry 2004 41 161-171 A study of substituent effect on 1H and 13C nmr spectra of N-and C-substituted carbazoles Sergio M. Bonesi,Maria A. Ponce and Rosa Erra-Balsells Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 22 . calix[4]amidocrown-5 C36H37O6N3 相似度:61.5% Journal of Heterocyclic Chemistry 2004 41 211-219 Synthesis and crystal structures of novel calix[4]azacrowns K. No,Hyun J. Lee,Ki M. Park,Shim S. Lee,Kwan H. Noh,Sung K. Kim,Ji Y. Lee and Jong S. Kim Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 23 . 5-benzyl-1-(4-fluorobenzyl-1H-imidazole C17H15FN2 相似度:61.5% Journal of Heterocyclic Chemistry 2003 40 229-241 Preparation of a clinically investigated ras farnesyl transferase inhibitor Peter E. Maligres,Marjorie S. Waters,Steven A. Weissman,J. Christopher McWilliams,Stephanie Lewis,Jennifer Cowen,Robert A. Reamer,R. P. Volante,Paul J. Reider and David Askin Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 24 . trans-(5S,6S)-4,5-dimethyl-2,6-diphenyl-5,6-dihydro-4H-1,3,4-oxadiazine C17H18N2O 相似度:61.5% Journal of Heterocyclic Chemistry 2010 47 982-989 Synthesis and X-ray crystal structures of chiral, nonracemic 5,6-dihydro-4H-1,3,4-oxadiazines Shawn R. Hitchcock, Melissa A. Dean, Christopher J. Kelley, Kate L. Edler and Gregory M. Ferrence Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 25 . compound 14d C19H20ClNO2S2 相似度:61.5% Indian Journal of Chemistry 2008 47B 1713-1725 Synthesis of a new class of 2-oxazolines and 2-thiazolines Padmaja,A; Payani,T; Mahesh,K Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 26 . (+)-4-benzyl-2H-benzo[1,4]thiazin-3(4H)-oneS-oxide 相似度:61.5% Heterocycles 2008 76 191-196 Asymmetric Oxidation of Cyclic Sulfides Catalyzed by an Aluminum(salalen) Complex as the Catalyst Kazuhiro Matsumoto, Tetsufumi Yamaguchi, and Tsutomu Katsuki Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 27 . 4-phenyl-4-(1H-1,2,3-triazol-1-yl)butan-2-one C12H13N3O 相似度:61.5% Heterocycles 2008 76 1141-1154 Regioselective Synthesis of Either 1H- or 2H-1, 2, 3-Triazoles via Michael Addition to α, β-Unsaturated Ketones Sen Wai Kwok, Jason E. Hein, Valery V. Fokin, and K. Barry Sharpless Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 28 . (Z)-3-(thiophen-2-ylmethylidenyl]-3H-benzothiophen-2-one C13H8OS2 相似度:61.5% Heterocycles 2004 63 1813-1819 Novel Synthesis of 3-Substituted Derivatives of (Alkyliden-1-yl)-3H-benzothiophen-2-ones Sukanta Kamila and Edward R. Biehl* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 29 . 1-(2-Methylphenyl)-1H-benzotriazole C13H11N3 相似度:61.5% Helvetica Chimica Acta 2010 93 1350-1354 A Novel and Regiospecific Synthesis of 1-Aryl-1H-benzotriazoles via Copper(I)-Catalyzed Intramolecular Cyclization Reaction Qi-Lun Liu, Di-Di Wen, Chen-Chen Hang, Qiu-Lian Li and Yong-Ming Zhu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 30 . 4-Phenyl-1-[2-(2-thienyl)ethyl]-1,2,3-triazole C14H13N3S 相似度:61.5% 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 -------------------------------------------------------------------------------- 31 . iminosulfonium phenacylide C21H19NOS 相似度:61.5% Tetrahedron Letters 2001 42 6151-6154 Synthesis, structure, and reactivity of iminosulfonium ylides bearing an α-carbonyl group Takayoshi Fujii, Tetsuya Suzuki, Takashi Sato, Ernst Horn, Toshiaki Yoshimura Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 32 . 4-(benzylaminomethyl)-benzonitrile C15H14N2 相似度:61.5% Tetrahedron Letters 2002 43 8617-8620 Novel diacid accelerated borane reducing agent for imines Zhi-Hui Lu, Nandkumar Bhongle, Xiping Su, Seth Ribe, Chris H Senanayake Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 33 . compound 1b 相似度:61.5% Tetrahedron Letters 2004 45 6165-6167 The use of McMurry coupling for the synthesis of indolophanes and cis-stilbenophanes Perumal Rajakumar, Merikapudi Gayatri Swaroop Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 34 . p-Phenylbenzonitrile 相似度:61.5% Heterocycles 2011 83 163-169 Palladium-Catalyzed Cyanation of Aryl Bromides Using Phosphine-Free Pyridylhydrazone Ligands Takashi Mino,* Tomoko Koizumi, Masanori Shibuya, Kiminori Hirai, Masami Sakamoto, and Tsutomu Fujita Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 35 . 1-(4-chlorophenyl)-4-{[1-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl}piperazine C20H20Cl2N4 相似度:61.5% Bioorganic & Medicinal Chemistry 2010 18 1925-1935 Searching for multi-target antipsychotics: Discovery of orally active heterocyclic N-phenylpiperazine ligands of D2-like and 5-HT1A receptors Gilda Neves, Ricardo Menegatti, Camila B. Antonio, Luiza R. Grazziottin, Renan O. Vieira, Stela M.K. Rates, François Noël, Eliezer J. Barreiro, Carlos A.M. Fraga Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 36 . N-phenyl-10H-phenothiazine-10-carboxamide C19H14N2OS 相似度:61.5% Bioorganic & Medicinal Chemistry 2010 18 2232-2244 Differential binding of phenothiazine urea derivatives to wild-type human cholinesterases and butyrylcholinesterase mutants Sultan Darvesh, Ian R. Pottie, Katherine V. Darvesh, Robert S. McDonald, Ryan Walsh, Sarah Conrad, Andrea Penwell, Diane Mataija, Earl Martin Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 37 . 4-N-methyl-2'-methoxy-stilbene C15H14BrN 相似度:61.5% Bioorganic & Medicinal Chemistry 2010 18 7724-7730 Synthesis and evaluation of stilbene derivatives as a potential imaging agent of amyloid plaques Myeng Chan Hong, Yun Kyung Kim, Jae Yong Choi, Si Qiang Yang, Hakjune Rhee, Young Hoon Ryu, Tae Hyun Choi, Gi Jeong Cheon, Gwang Il An, Hye Yun Kim, Youngsoo Kim, Dong Jin Kim, Jun-Seok Lee, Young-Tae Chang, Kyo Chul Lee Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 38 . 4-N-methyl-3'-methoxy-stilbene C15H14BrN 相似度:61.5% Bioorganic & Medicinal Chemistry 2010 18 7724-7730 Synthesis and evaluation of stilbene derivatives as a potential imaging agent of amyloid plaques Myeng Chan Hong, Yun Kyung Kim, Jae Yong Choi, Si Qiang Yang, Hakjune Rhee, Young Hoon Ryu, Tae Hyun Choi, Gi Jeong Cheon, Gwang Il An, Hye Yun Kim, Youngsoo Kim, Dong Jin Kim, Jun-Seok Lee, Young-Tae Chang, Kyo Chul Lee Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 39 . N-(4-nitro phenyl)-3-phenyl propionamide 相似度:61.5% Bioorganic & Medicinal Chemistry 2009 17 4681-4692 Design, synthesis and biological evaluation of novel triazole, urea and thiourea derivatives of quinoline against Mycobacterium tuberculosis Ram Shankar Upadhayaya, Girish M. Kulkarni, Nageswara Rao Vasireddy, Jaya Kishore Vandavasi, Shailesh S. Dixit, Vivek Sharma, Jyoti Chattopadhyaya Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 40 . 5-N-(Benzotriazol-1-ylmethyl)amino-1-phenyl-3-tert-butylpyrazole C20H22N6 相似度:60% Tetrahedron Letters 2002 43 5617-5620 An unexpected chemical behavior of 5-N-(benzotriazol-1-ylmethyl)amino-3-tert-butyl-1-phenylpyrazole Rodrigo Abonia, Emerson Rengifo, Jairo Quiroga, Braulio Insuasty, Adolfo Sánchez, Justo Cobo, John Low, Manuel Nogueras Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 41 . N-Benzyl-N-[2-chloro-1-methyl-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]amine C18H18ClN3O 相似度:57.1% Helvetica Chimica Acta 2011 94 1024-1029 One-Pot, Four-Component Synthesis of Fully Substituted 1,3,4-Oxadiazole Derivatives from (Isocyanoimino)triphenylphosphorane, a Primary Amine,an Aromatic Carboxylic Acid, and Chloroacetone Ali Ramazani, Fatemeh Zeinali Nasrabadi, and Yavar Ahmadi Structure 13C NMR 碳谱模拟图 |
2楼2012-04-19 08:50:30