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feiyao6666金虫 (小有名气)
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[求助]
求助微谱数据查询
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29.7,40.4,41.8,43.8,44.3,125.5,125.6,127.4,127.7,127.9,145.3 [ 来自科研家族 天然产物家族 ] |
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peter002
木虫 (正式写手)
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【答案】应助回帖
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感谢参与，应助指数 +1
feiyao6666: 金币+20, ★★★很有帮助 2012-10-15 15:23:00
感谢参与，应助指数 +1
feiyao6666: 金币+20, ★★★很有帮助 2012-10-15 15:23:00
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查询模式：模糊查询 碳谱数据输入： 按从小到大顺序输入，数字间用英文半角逗号(,)分隔例如： 21.4,30.4,37.4,73.2,73.7,125.6,126.6,139.6,140.2,168.2 溶剂选项： 匹配容差： (数字格式，可自行设定) 相似度： %(相似度>=50%) 查询结果：共查到308个化合物(查询结果仅供参考) 1 . 1,5-diphenylpentane-1,3-diol C17H20O2 相似度:63.6% Chemical & Pharmaceutical Bulletin 1987 35 108-111 Constituents of Wikstroemia sikokiana. II.Absolute Configurations of 1, 5-Diphenylpentane-1, 3-diols MASATAKE NIWA,PEI-FENG JIANG and YOSHIMASA HIRATA Structure 13C NMR 碳谱模拟图 2 . 1,1-diphenyl-cyclopropan 相似度:63.6% Helvetica Chimica Acta 1978 61 661-668 Einfluss der Orientierung von Substituenten auf die chemische Verschiebung von 13C. II. 13C-NMR.-spektroskopische Untersuchung von substituierten Spiro [cyclopropan-1',9-fluorenen] Hans Fritz, Tammo Winkler, André M. Braun and Christian Decker Structure 13C NMR 碳谱模拟图 3 . 5-oxo-7-phenylheptanal C13H16O2 相似度:63.6% Journal of Heterocyclic Chemistry 2003 40 113-120 N-phenyl-substituted pyrrolidines,piperidines and azabicyclics by a tandem reduction-double reductive amination reaction Richard A. Bunce,Derrick M. Herron,Jason R. Lewis and Sharadsrikar V. Kotturi Structure 13C NMR 碳谱模拟图 4 . Compound 8 相似度:63.6% Magnetic Resonance in Chmesitry 2005 43 346-347 Detailed assignments of 1H and 13C NMR spectral data of 13 β-substituted cycloenones Mauricio Gomes Constantino, Valdemar Lacerda Júnior and Gil Valdo José da Silva Structure 13C NMR 碳谱模拟图 5 . compound 13 C48H33Br3 相似度:63.6% Tetrahedron Letters 2002 43 6557-6560 A rapid, two step construction of novel C48H24 and C54H24 polycyclic aromatic hydrocarbons represented on the C60-fullerene surface via a threefold intramolecular Heck coupling reaction Goverdhan Mehta, P.V.V.Srirama Sarma Structure 13C NMR 碳谱模拟图 6 . (R,S)-N-benzyl 2-methyl-2-phenylacetamide C16H17NO 相似度:63.6% Bioorganic & Medicinal Chemistry 1996 4 2105-2114 The anticonvulsant activities of functionalized N-benzyl 2-acetamidoacetamides. The importance of the 2-acetamido substituent Daeock Choi, James P Stables, Harold Kohn Structure 13C NMR 碳谱模拟图 7 . [3-(2-Bromoethyl)cyclohexa-1,4-dien-3-yl]-tert-butylmethylphosphane-Borane C13H25BBrP 相似度:63.6% European Journal of Organic Chemistry 2012 2521-2534 In Situ Dearomatisation/Alkylation of Arylphosphane Derivatives Marek Stankevi, Karolina Wójcik, Magdalena Jaklińska and K. Micha Pietrusiewicz Structure 13C NMR 碳谱模拟图 8 . 1-(4-methanesulfonylphenyl)-5-phenyl-1H-[1,2,3]triazole 相似度:63.6% Bioorganic & Medicinal Chemistry 2009 17 1146-1151 Synthesis and cyclooxygenase inhibition of various (aryl-1,2,3-triazole-1-yl)-methanesulfonylphenyl derivatives Frank Wuest, Xinli Tang, Torsten Kniess, Jens Pietzsch, Mavanur Suresh Structure 13C NMR 碳谱模拟图 9 . N,N'-di-(4-nitrobenzenesulfonyl)-1,8-diaminooctane C20H26N4O8S2 相似度:63.6% Bioorganic & Medicinal Chemistry 2008 16 5862-5870 Synthesis of Hsp90 inhibitor dimers as potential antitumor agents Kazuhiro Muranaka, Akiko Sano, Satoshi Ichikawa, Akira Matsuda Structure 13C NMR 碳谱模拟图 10 . poly[1-(2-naphthyl)-3,5,7-triphenyloctamethylene] 相似度:63.6% Russian Journal of Organic Chemistry 2004 40 795-801 Lithiation Reactions Catalyzed by Linear and Cross-Linked Arene-Based Polymers. Generation of Functionalized Organolithium Compounds P. Candela, C. Gómez and M. Yus Structure 13C NMR 碳谱模拟图 11 . poly[1-(4-biphenylyl)-3,5,7-triphenyloctamethylene] 相似度:63.6% Russian Journal of Organic Chemistry 2004 40 795-801 Lithiation Reactions Catalyzed by Linear and Cross-Linked Arene-Based Polymers. Generation of Functionalized Organolithium Compounds P. Candela, C. Gómez and M. Yus Structure 13C NMR 碳谱模拟图 12 . (1S,2S,4S)-2-mercapto-4-phenylcyclohexan-1-ol 相似度:63.6% Tetrahedron 2012 68 6438-6446 TBD-catalyzed α-sulfenylation of cyclic ketones: desymmetrization of 4-substituted cyclohexanones Belén Poladura, 渀最攀氀 Martínez-Casta攀搀愀, Humberto Rodríguez-Solla, Carmen Concellón, Vicente del Amo Structure 13C NMR 碳谱模拟图 13 . 1,3-diphenylbut-1-ene 相似度:63.6% European Journal of Organic Chemistry 2010 6233-6238 Amberlyst-15 in Ionic Liquid: An Efficient and Recyclable Reagent for Nucleophilic Substitution of Alcohols and Hydroamination of Alkenes Ziyauddin S. Qureshi, Krishna M. Deshmukh, Pawan J. Tambade, Kishor P. Dhake and Bhalchandra M. Bhanage Structure 13C NMR 碳谱模拟图 14 . 4-Phenylbutan-2-one 相似度:63.6% Molecules 2011 16 367-372 Ni(0)-CMC-Na Nickel Colloids in Sodium Carboxymethyl-Cellulose: Catalytic Evaluation in Hydrogenation Reactions Mohamed Anouar Harrad, Pedro Valerga, M. Carmen Puerta, Issam Houssini, Mustapha Ait Ali, Larbi El Firdoussi and Abdallah Karim Structure 13C NMR 碳谱模拟图 15 . compound 14b 相似度:61.5% Tetrahedron Letters 2004 45 8815-8818 Efficient guanylation of Nα,Nω-difunctionalized polyamines at the secondary amino functions Constantinos M. Athanassopoulos, Thomas Garnelis, Evangelia Pantazaka, Dionissios Papaioannou Structure 13C NMR 碳谱模拟图 16 . 1-methyl-1,2,3,4-tetrahydrobenzo[g]quinoline C14H15N 相似度:61.5% European Journal of Organic Chemistry 2011 3238-3245 Bidentate Lewis Acids for the Activation of 1,2-Diazines – A New Mode of Catalysis Simon N. Kessler, Markus Neuburger and Hermann A. Wegner Structure 13C NMR 碳谱模拟图 17 . calyxolane A C16H16O 相似度:58.3% Journal of Natural Products 1997 60 915-917 The Calyxolanes: New 1, 3-Diphenylbutanoid Metabolites Isolated from the Caribbean Marine Sponge Calyx podatypa Abimael D. Rodríguez, Oscar M. Cóbar, and Omayra L. Padilla Structure 13C NMR 碳谱模拟图 18 . compound 3f 相似度:58.3% Heterocycles 2007 71 419-428 Synthesis of 5-Substituted 4, 5, 6, 7-Tetrahydroindoles from Cyclohexanones Chang Kiu Lee, In-Sook Han Lee, and Wayland E. Noland Structure 13C NMR 碳谱模拟图 19 . compound 2d 相似度:58.3% Tetrahedron Letters 2001 42 5557-5559 Stereoselective electrochemical transformation of 4-substituted cyclohexanones into cis-5-substituted-2,2-dimethoxycyclohexanols Michail N. Elinson, Sergey K. Feducovich, Dmitry E. Dmitriev, Alexander S. Dorofeev, Anatolii N. Vereshchagin, Gennady I. Nikishin Structure 13C NMR 碳谱模拟图 20 . 3,6-bis((1S-2R)-(2-hydroxy-indan-1-yl)aminomethyl)pyridazine C24H26N4O2 相似度:58.3% Tetrahedron Letters 2002 43 11-13 C2-chiral dinucleating ligands with a 3,6-disubstituted pyridazine core Alexandre Picot, Fran?N椀猀 P Gabba Structure 13C NMR 碳谱模拟图 21 . compound 16 C16H16ClN 相似度:58.3% Bioorganic & Medicinal Chemistry 2000 8 691-698 Inhibitors of the fungal cell wall. Synthesis of 4-aryl-4-N-arylamine-1-butenes and related compounds with inhibitory activities on β(1–3) glucan and chitin synthases Juan M Urbina, Juan C.G Cortés, Alirio Palma, Silvia N López, Susana A Zacchino, Ricardo D Enriz, Juan C Ribas, Vladimir V Kouznetzov Structure 13C NMR 碳谱模拟图 22 . rac-4-Phenyl-cyclohexen-1-yl-isocyanide C13H13N 相似度:58.3% Bioorganic & Medicinal Chemistry 2000 8 1343-1360 Multicomponent synthesis of novel amino acid–nucleobase chimeras: a versatile approach to PNA-monomers Wolfgang Maison, Imre Schlemminger, Ole Westerhoff, Jürgen Martens Structure 13C NMR 碳谱模拟图 23 . 1-Hydroxy-1,5-diphenylpentan-3-one 相似度:58.3% Bulletin of the Chemical Society of Japan 2003 76 813-823 Stereoselective Crossed Aldol Reaction via Boron Enolates Generated from α-Iodo Ketones and 9-Borabicyclo[3.3.1]nonane Teruaki Mukaiyama, Tomofumi Takuwa, Keiko Yamane, Shouhei Imachi Structure 13C NMR 碳谱模拟图 24 . compound 5f C20H20O2 相似度:58.3% European Journal of Organic Chemistry 2012 2643-2655 A Joint Experimental and Computational Investigation on Homoconjugated Push-Pull Chromophores Derived from 7,7-Diphenylnorbornane Noelia Herrero-García, María del Rosario Colorado Heras, María del Rosario Torres, Israel Fernández and José Osío Barcina Structure 13C NMR 碳谱模拟图 25 . compound 2m C12H16O 相似度:58.3% European Journal of Organic Chemistry 2012 2579-2584 High Regiocontrol in the Zinc-Mediated Crotylation of Aldehydes and Ketones: A Straightforward and Facile Approach to Linear Homoallylic Alcohols in DMPU Li-Ming Zhao, Li-Jing Wan, Hai-Shan Jin and Shu-Qing Zhang Structure 13C NMR 碳谱模拟图 26 . compound 2q C12H15ClO 相似度:58.3% European Journal of Organic Chemistry 2012 2579-2584 High Regiocontrol in the Zinc-Mediated Crotylation of Aldehydes and Ketones: A Straightforward and Facile Approach to Linear Homoallylic Alcohols in DMPU Li-Ming Zhao, Li-Jing Wan, Hai-Shan Jin and Shu-Qing Zhang Structure 13C NMR 碳谱模拟图 27 . N,N'-di-(4-nitrobenzenesulfonyl)-1,12-diaminododecane C24H34N4O8S2 相似度:58.3% Bioorganic & Medicinal Chemistry 2008 16 5862-5870 Synthesis of Hsp90 inhibitor dimers as potential antitumor agents Kazuhiro Muranaka, Akiko Sano, Satoshi Ichikawa, Akira Matsuda Structure 13C NMR 碳谱模拟图 28 . 1-methyl-5-phenyl-3-(thiophen-3-yl)-4,5-dihydro-1H-pyrazole C14H14N2S 相似度:58.3% European Journal of Organic Chemistry 2011 4919-4924 A Straightforward Synthesis of Pyrazolines and Pyrazoles: Palladium-Catalyzed Carbonylative Vinylation–Cyclocondensation Reactions of Aryl Halides Xiao-Feng Wu, Helfried Neumann and Matthias Beller Structure 13C NMR 碳谱模拟图 29 . compound (E)-4e 相似度:58.3% European Journal of Organic Chemistry 2010 565-571 FeX3-Promoted Intermolecular Addition of Benzylic Alcohols to Aromatic Alkynes: A Mild and Efficient Strategy for the Synthesis of Alkenyl Halides Kai Ren, Min Wang and Lei Wang Structure 13C NMR 碳谱模拟图 30 . 3,3-dimethyl-1,2-diphenylbutan-1-ol (α-isomer) 相似度:58.3% Organic Magnetic Resonance 1983 21 520-523 Assignment of relative configurations to acyclic diastereomeric carbinols with the lanthanide shift reagent Eu (fod)3 by 1H and 13C NMR C. Alvarez Ibarra, M. L. Quiroga Feijoo, M. S. Arias Perez and J. de la Orden Parra Structure 13C NMR 碳谱模拟图 31 . (R)-3-(4-Trifluoromethylphenyl)cyclohexanone C13H13F3O 相似度:58.3% European Journal of Organic Chemistry 2012 1179-1185 Cu-Catalyzed Enantioselective 1,4-Additions of Aryl-Grignard Reagents to Cyclohexenone in the Presence of TADDOL-Derived Phosphane-Phosphite Ligands Qaseem Naeemi, Mehmet Dindaro氁甀, Darius P. Kranz, Janna Velder and Hans-Günther Schmalz Structure 13C NMR 碳谱模拟图 32 . piperchabamide A C14H15NO2 相似度:57.1% Planta Medica 2004 70 152-159 New Amides and Gastroprotective Constituents from the Fruit of Piper chaba Morikawa, Toshio; Matsuda, Hisashi; Yamaguchi, Itadaki; Pongpiriyadacha, Yutana; Yoshikawa, Masayuki Structure 13C NMR 碳谱模拟图 33 . compound 11 C14H16O 相似度:57.1% Tetrahedron Letters 2004 45 257-259 Studies towards the synthesis of FCRR toxin: an expeditious entry into 7-5-6 ring systems via [5+2] oxidopyrylium-alkene cycloaddition U. Murali Krishna, G.K. Trivedi Structure 13C NMR 碳谱模拟图 34 . N1,N1-(ethane-1,2-diyl)bis[N3-(naphthalen-2-yl)propane-1,3-di-amine] C28H34N4 相似度:57.1% European Journal of Organic Chemistry 2011 6240-6253 Copper-Catalyzed Arylation of Oxadiamines and Polyamines Maxim V. Anokhin, Alexei D. Averin and Irina P. Beletskaya Structure 13C NMR 碳谱模拟图 35 . (1S,2R,6S)-1,2-diphenyl-7-aza-bicyclo[4.1.0]heptane 相似度:57.1% Organic Magnetic Resonance 1976 8 90-94 Etude RMN 13C d'aziridines non substituées sur l'azote II—Aza-7 bicyclo[4.1.0]heptanes, configurations relatives et conformations privilégiées P. Mison, R. Chaabouni, Y. Diab, A. Laurent, R. Martino, A. Lopez, F. W. Wehrli and T. Wirthlin Structure 13C NMR 碳谱模拟图 36 . 1-(1H-imidazol-1-yl)-3,5-diphenylpentan-3-ol C20H22N2O 相似度:56.2% Archiv der Pharmazie 2011 344 794-801 Synthesis and Anti-Candida Potential of Certain Novel 1-[(3-Substituted-3-phenyl)propyl]-1H-imidazoles (pages 794–801) Mohamed Nabil Aboul-Enein, Aida Abd El-Sattar El-Azzouny, Mohamed Ibrahim Attia, Ola Ahmed Saleh and Amany Lotfy Kansoh Structure 13C NMR 碳谱模拟图 37 . N1-(3-aminopropyl)-N3-(naphthalen-2-yl)propane-1,3-diamine C16H23N3 相似度:56.2% European Journal of Organic Chemistry 2011 6240-6253 Copper-Catalyzed Arylation of Oxadiamines and Polyamines Maxim V. Anokhin, Alexei D. Averin and Irina P. Beletskaya Structure 13C NMR 碳谱模拟图 38 . compound b 相似度:54.5% Chemical & Pharmaceutical Bulletin 1982 30 2279-2282 INHIBITORS OF PROSTAGLANDIN BIOSYNTHESIS FROM ALPINIA OFFICINARUM Fumiyuki Kiuchi,Masaaki Shibuya and Ushio Sankawa Structure 13C NMR 碳谱模拟图 39 . compound 11 C17H20O2 相似度:54.5% Chemical & Pharmaceutical Bulletin 1987 35 108-111 Constituents of Wikstroemia sikokiana. II.Absolute Configurations of 1, 5-Diphenylpentane-1, 3-diols MASATAKE NIWA,PEI-FENG JIANG and YOSHIMASA HIRATA Structure 13C NMR 碳谱模拟图 40 . 4-Isopropyl-3-methylaniline 相似度:54.5% Chemistry of Natural Compounds 1991 27 24-27 BECKMANN REARRANGEMENT OF THE E ISOMER OF CIS-4,6,6-TRIMETHYLBICYCLO[3.1.1]-HEPTAN-2-ONE OXIME S. S. Koval'skaya, N. G. Kozlov, and S. V. Shavyrin Structure 13C NMR 碳谱模拟图 41 . goniothalamin C13H12O2 相似度:54.5% Acta Botanica Sinica 1999 41 330-333 The Chemical Constituents in the Stem of Goniothalamus griffithii CHEN Si-Bao, YU Jing-Guang Structure 13C NMR 碳谱模拟图 42 . 3-hydroxy-3-methyl-5-phenylpentanoic acid 相似度:54.5% Molecules 1998 3 M61 3-Hydroxy-3-methyl-5-phenylpentanoic Acid Martin J. Stoermer and John T. Pinhey Structure 13C NMR 碳谱模拟图 43 . ethylphenylcarbinol 相似度:54.5% Phytochemistry 1976 15 1547-1551 13C NMR spectroscopy of neolignans Ernest Wenkert, Hugo E. Gottlieb, Otto R. Gottlieb, Marilia O. da S. Pereira, Mariza D. Formiga Structure 13C NMR 碳谱模拟图 44 . compound 3b 相似度:54.5% Phytochemistry 1976 15 1547-1551 13C NMR spectroscopy of neolignans Ernest Wenkert, Hugo E. Gottlieb, Otto R. Gottlieb, Marilia O. da S. Pereira, Mariza D. Formiga Structure 13C NMR 碳谱模拟图 45 . 4-cumylphenol 相似度:54.5% China Journal of Chinese Materia Medica 2005 30 1162-1165 Studies on chemical constitutes of green alga Chaetomorpha basiretorsa and their bioactivity Shi Dayong, HAN Lijun, SUN Jie, YANG Yongchun, SHI Jiangong, FAN Xiao Structure 13C NMR 碳谱模拟图 46 . goniothalamin C13H12O 相似度:54.5% Phytochemistry 2000 53 811-819 6-[ω-arylalkenyl]-5,6-dihydro-α-pyrones from Cryptocarya moschata (Lauraceae) Alberto José Cavalheiro, Massayoshi Yoshida Structure 13C NMR 碳谱模拟图 47 . 5,6-2H-6-styryl-2-pyrone 相似度:54.5% Acta Pharmaceutica Sinica 1999 Vol 34 132-134 STUDIES ON THE CHEMICAL CONSTITUENTS OF GONIOTHALAMUS GRIFFITHII HOOK.F.ET THOMS Hu Zhengbo (Hu ZB); Liao Shixuan (Liao SX); Mao Shilong (Mao SL); Zhu Hongping (Zhu HP); Xu Song (Xu S) and Liang Huaqing (Liang HQ) Structure 13C NMR 碳谱模拟图 48 . N-Propylphenyl-4-hydroxy-2,3-dehydro-γ-lactame C13H15NO2 相似度:54.5% 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 49 . trans-Cinnamyl phenyl selenide 相似度:54.5% Canadian Journal of Chemistry 2009 87 678-683 On the reactivity of indium(III) benzenechalcogenolates (chalcogen = sulfur and selenium) towards organyl halides for the synthesis of organyl phenyl chalcogenides Clovis Peppe and Liérson Borges de Castro Structure 13C NMR 碳谱模拟图 50 . 4-Chloro-N-benzylpyridine-2-carboxamide C13H11ClN2O 相似度:54.5% Molecules 2012 17 1124-1137 New Sorafenib Derivatives: Synthesis, Antiproliferative Activity Against Tumour Cell Lines and Antimetabolic Evaluation 攁氀樀欀愀 Babi, Maja Crkven椁, Zrinka Raji, Ana-Matea Mikecin, Marijeta Kralj,Jan Balzarini, Mariya Petrova, Jos Vanderleyden and Branka Zorc Structure 13C NMR 碳谱模拟图 51 . Compound 64 相似度:54.5% Bioorganic & Medicinal Chemistry 2012 20 1029-1045 Cyclohexane 1,3-diones and their inhibition of mutant SOD1-dependent protein aggregation and toxicity in PC12 cells Wei Zhang,Radhia Benmohamed,Anthony C. Arvanites, Richard I. Morimoto, Robert J. Ferrante,Donald R. Kirsch, Richard B. Silverman Structure 13C NMR 碳谱模拟图 52 . 1,3-diphenyl-4H-pyrazol-5-thione C15H12N2S 相似度:54.5% 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 53 . 9-phenylmethylamino-2,3,4,5,6,7-hexahydro-1,3,8-thiadiazonine-2-thione C13H17N3S2 相似度:54.5% Journal of Heterocyclic Chemistry 2006 43 593-598 Thermolysis of N,N″-1,ω-alkanediyl-bis[n'-organylthiourea] derivatives Alaa A. Hassan and Dietrich D甀瀀瀀 Structure 13C NMR 碳谱模拟图 |
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