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[求助]
求助微谱数据
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21.66,25.6,30.6,57.82,63.42,68.32,72.91,109.55,145.67,177.62 21.66,25.6,30.6,57.82,63.42,68.32,72.91,98.53,102.41,109.55,145.67,177.62 |
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kaola0916
铁杆木虫 (著名写手)
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【答案】应助回帖
★
感谢参与，应助指数 +1
karl2100: 金币+1, 谢谢！ 2012-06-18 22:07:56
感谢参与，应助指数 +1
karl2100: 金币+1, 谢谢！ 2012-06-18 22:07:56
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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 21.66,25.6,30.6,57.82,63.42,68.32,72.91,109.55,145.67,177.62 溶剂选项： 全部 CDCl3 CD3CD2OD CD2Cl2 C5D5N C3D7NO CD3SOCD3 C4D8O (CH3)4Si C4D8O2 CD3COOD C4D8O2 H2O D2O CF3COOD CD3OD ND3 CD3COCD3 C6D6 CD3CN 查询空值 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41个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . 6-vinyl-3β-hydroxy-2,2,6α-trimethyltetrahydropyran 相似度:60% Russian Journal of Organic Chemistry 2002 38 498-506 Rearrangements of Epoxides of Linalool and Nerolidyl Acetate in Acid Media T. M. Khomenko, L. E. Tatarova, D. V. Korchagina and V. A. Barkhash Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . (2S)-5-{[(tert-Butyl)(dimethyl)silyl]oxy}-2-hydroxypentyl 4-Methylbenzenesulfonate 相似度:58.3% Helvetica Chimica Acta 2011 94 1226-1233 Asymmetric Total Synthesis of Stagonolide G Dasari Ramesh, Singanaboina Rajaram, Peddikotla Prabhakar, Udugu Ramulu, Dorigondla Kumar Reddy, and Yenamandra Venkateswarlu* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . compound 14b 相似度:54.5% The Journal of Antibiotics 1987 40 496-504 THE STRUCTURE OF INDUCING FACTORS FOR VIRGINIAMYCIN PRODUCTION IN STREPTOMYCES VIRGINIAS YASUHIRO YAMADA, KAZUHIRO SUGAMURA, KOICHI KONDO, MASAKATSU YANAGIMOTO, HIROSUKE OKADA Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . (R)-5-Ethylnonane-2,4-dione 相似度:50% Journal of Natural Products 2006 69 863-870 Ethyl-Branched Aldehydes, Ketones, and Diketones from Caimans (Caiman and Paleosuchus; Crocodylia, Reptilia) Karsten Krckert, Birte Flachsbarth, Stefan Schulz, Ute Hentschel, and Paul J. Weldon Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . 3α-hydroxymenthol C10H20O2 相似度:50% Journal of Natural Products 1998 61 1340-1342 Fungal Transformation of (1R, 2S, 5R)-(-)-Menthol by Cephalosporium aphidicola Atta-ur-Rahman, Muhammad Yaqoob, Afgan Farooq, Shazia Anjum, Fahim Asif, and M. Iqbal Choudhary Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . N-(1'-Hydroxycyclohexyl)methyl-N-methylthiopivalamid C13H25NOS 相似度:50% Helvetica Chimica Acta 1980 63 102-116 Nucleophile Aminoalkylierung mit Thiopivalamiden Winfried Lubosch, Dieter Seebach Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . (8R)-deca-2-trans-2-ene-4,6-diyn-1,8-diol C10H14ON 相似度:50% Natural Product Research 2006 20 1098-1104 Two new naturally occurring optical polyacetylene compounds from Torricellia angulata var intermedia and the determination of their absolute configurations Weidong Pan; Yongmin Zhang; Bixue Xu; Peixue Cao; Guangyi Liang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . 3,4-O-isopropylideneshikimic acid 相似度:50% China Journal of Chinese Materia Medica 2007 32 1706-1708 Chemical Constitues of Two Liverworts Dumortiera hirsute and Pallavicinia ambigua XIE Chunfeng, LI Zijing, QU Jianbo, SUN Bin, LOU Hongxiang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . thomandersine acetate C10H13NO2 相似度:50% Phytochemistry 1995 39 1249-1251 Thomandersine and isothomandersine, 2-indolinone alkaloids from Thomandersia laurifolia Bonaventure Tchaleu Ngadjui, Helene Tamboue, J. Foyere Ayafor, Joseph D. Connolly Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . 鲛肝醇 相似度:50% Chinese Journal of Marine Drugs 2000 19(1) 1-3 STUDIES ON THE CHEMICAL CONSTITUENTS OF THE TUNICATE STYELACANOPUS FROM THE DAYAWAN BAY Wang Chaojie, Su Jing yu, Zeng Longmei Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . batyl alcohol 相似度:50% Chinese Journal of Marine Drugs 1999 3 4-6 STUDIES ON THE CHEMICAL CONSTITUENTS OF THE SPONGE RIEMNA FORTIS FROM SOUTH CHINA SEA Deng Songzhi, Tian Chunlei, Xiao DingJun Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . compound 18 相似度:50% Tetrahedron Letters 2000 41 823-826 Total synthesis of lipoxin A4 and lipoxin B4 from butadiene A. Rodríguez, M. Nomen, B. W. Spur, J. J. Godfroid, T. H. Lee Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . (3R,6R)-tetrahydro-6-ethenyl-2,2,6-trimethyl-4H-pyran-3-ol C10H18O2 相似度:50% Indian Journal of Chemistry 2005 44B 1922-1926 Composition of a new chemotype of Tanacetum nubigenum Chanotiya,C S; Sammal,S S; Mathela,C S Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . compund 10 C10H9F3O5S 相似度:50% Heterocycles 2010 80 313-328 Total Synthesis of (+)-Cacospongionolide B Motoko Oshida, Misaki Ono, Atsuo Nakazaki, and Susumu Kobayashi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . 3,3,5-trimethyl-6,7,8-trioxabicyclo[3.2.1]octane-1-carbaldehyde-O-methyloxime C10H17NO4 相似度:50% Heterocycles 2010 81 2323-2334 Ozonolyses of Isophorone and of 3-Methyl-2-cyclohexen-1-one and Subsequent Reactions of the Respective Ozonides to Afford Di-, Tri- and Tetraozonides In Chan Jung, Sad Alam Sheikh, Byong-Mun Jon, Wei Li, Bon-Suk Goo, and In-Soo Jeong Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . tert-butyl-[(Z)-3-iodo-2-methylallyloxy]dimethylsilane C10H21IOSi 相似度:50% Heterocycles 2009 77 493-505 Synthesis of 6Z-Pandanamine by Regioselective Cyclization Reaction of 2-En-4-ynoic Acid Derivatives Promoted by Weak Base Kou Hiroya, Kazuya Takuma, Kiyofum Inamoto, and Takao Sakamoto Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 17 . rac-cis-2-(2-methallyloxy)cyclohexanol C10H18O2 相似度:50% Heterocycles 2009 77 1123-1146 Synthesis of Annulated 1,4-Dioxanes and Perhydro-1,4-oxazines by Domino-Wacker-Carbonylation and Domino-Wacker-Mizoroki-Heck Reactions Lutz F. Tietze, Arne Heins, Mohammad Soleiman-Beigi, and Christian Raith Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 18 . 5,7,8,9-tetrahydrooxepino[4,3-d]pyrimidine-2,4-dione 相似度:50% Heterocycles 2004 63 2523-2536 Synthesis of the Novel Bicyclic Oxepinopyrimidine and Fluorinated Pyrrolidinopyrimidines Sanja Batinac, Draginja Mrvos Sermek, Mario Cetina, Kresimir Pavelic, Mladen Mintas, and Silvana Raic-Malic* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 19 . cis-linalool oxide 相似度:50% Phytochemical Analysis 1998 9 10-13 Stereoisomeric flavour compounds. LXXVIII. Separation and structure elucidation of the pyranoid linalool oxide stereoisomers using common gas chromatographic phases, modified cyclodextrin phases and nuclear magnetic resonance spectroscopy Barbara Weinert, Matthias Wüst, Armin MosandL and Helmut Hanssum Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 20 . Compound 6 相似度:50% Magnetic Resonance in Chmesitry 2001 39 141-146 1H and 13C NMR conformational study of N-substituted hexahydrocyclopent[e][1, 3]-oxazin-4-ones and hexahydro-2H-1, 3-benzoxazin-4-ones Roustem A. Shaikhutdinov, Karel D. Klika, Ferenc Fülöp and Kalevi Pihlaja Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 21 . 3,-O-异亚丙莽草酸 相似度:50% Chinese Traditional and Herbal Drugs 1999 30(8) 573-574+583 多蕊红茴香化学成分的研究 王晓强,郭亚健,杨春澍 Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 22 . 2-Azido-4-isopropenyl-1-methyl-cyclohexylamine 相似度:50% Tetrahedron Letters 2005 46 6907-6910 Regio- and diastereoselective synthesis of bifunctionalized limonenes Michael V. Voronkov, Ramanaiah C. Kanamarlapudi, Paul Richardson Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 23 . 3,4-O-isopropylideneshikimic acid 相似度:50% Chinese Pharmaceutical Journal 2007 42 1706-1708 Chemical Constituents of Two Liverworts Dumortiera hirsute and Pallavicinia ambigua XIE Chun-feng, LI Zi-jing, QU Jian-bo, SUN Bin, LOU Hong-xiang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 24 . (E)-2,2'-Azobis-(1-nitro-nonane) N,N'-dioxide C18H36N4O6 相似度:50% Archiv der Pharmazie 1998 331 111-117 Pseudonitrosites and Other Azodioxides with Vicinal Electron Acceptors Klaus Rehse and Martin Herpel Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 25 . 2-(2'-Acetoxyethyl)cyclohexan-1-al C10H18O3 相似度:50% Bioorganic & Medicinal Chemistry 1997 5 253-261 The synthesis of (R)-(+)-lipoic acid using a monooxygenase-catalysed biotransformation as the key step Brian Adger, M.Teresa Bes, Gideon Grogan, Raymond McCague, Sandrine Pedragosa-Moreau, Stanley M. Roberts, Raffaella Villa, Peter W.H. Wan, Andrew J. Willets Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 26 . (±)-trans-2-Tetrahydro-2H-2-pyranyloxy-1-cyclopropane carboxamide C9H15NO3 相似度:50% Zeitschrift für Naturforschung B 2002 57 1169-1173 Synthesis of Rigid Cyclopropanoid Nucleoside Analogues R. Csuk and A. Ker Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 27 . (2S)-2-Amino-1,3-dihydroxy-15-methylhexadecane C17H37NO2 相似度:50% Organic & Biomolecular Chemistry 2007 5 3826-3833 Structural confirmation of the dihydrosphinganine and fatty acid constituents of the dental pathogen Porphyromonas gingivalis JiYoung Mun, Amber Onorato, Frank C. Nichols, Martha D. Morton, Abdullah I. Saleh, Morgan Welzel and Michael B. Smith Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 28 . (±)-(8R,8aR)-8-(4-chlorophenyl)-8-hydroxyhexahydroindolizin-3(5H)-one C14H16ClNO2 相似度:50% Tetrahedron 2012 68 3692-3700 Application of the intramolecular PIFA-mediated amidation of alkynes to the synthesis of substituted indolizidinones Original Research Article Leticia M. Pardo, Imanol Tellitu, Esther Domínguez Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 29 . 3-octadecyloxy-propane-1,2-diol 相似度:50% Natural Product Research and Development 2003 15 109-112 STUDIES ON CHEMICAL CONSTITUENTS FROM ACROPORA PULCHRA XU Shi hai; YANG Kai; GUO Shu hao; LIU Ying ping Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 30 . compound 相似度:50% Tetrahedron 1987 43 935-945 Sedum alkaloids. X. Structure and synthesis of new 3- and 5-hydroxypiperidine alkaloids W. Ibebeke-Bomangwa, C. Hootelé(rk) Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 31 . (1R,2R,4R)-1-acetoxy-4-hydroxy-2-[(methoxymethyl)oxy]-cyclohexane C10H19O5 相似度:50% Tetrahedron 1999 55 3855-3870 Total synthesis of paniculide A from d-glucose Seiji Amano, Noriaki Takemura, Masami Ohtsuka, Seiichiro Ogawa, Noritaka Chida Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 32 . 1,2-dihydroxyperillyl alcohol C10H18O3 相似度:50% Natural Product Communications 2011 6 1805-1806 Microbial Hydroxylation of S-(-)-Perillyl Alcohol by Fusarium heterosporium Ismail Kiran Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 33 . 3-(vinyloxy)(1-nitrocyclohexylmethyl)propan-1-amin C12H22N2O3 相似度:50% Russian Journal of Organic Chemistry 2009 45 1248-1249 N-(1-nitroalkylmethyl)-2(3)-vinyloxyalkylamines B. F. Kukharev, V. K. Stankevich, E. Kh. Sadykov, G. R. Klimenko and N. A. Lobanova, et al. Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 34 . compound IIa 相似度:50% Russian Journal of Organic Chemistry 2002 38 498-506 Rearrangements of Epoxides of Linalool and Nerolidyl Acetate in Acid Media T. M. Khomenko, L. E. Tatarova, D. V. Korchagina and V. A. Barkhash Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 35 . compound IIb 相似度:50% Russian Journal of Organic Chemistry 2002 38 498-506 Rearrangements of Epoxides of Linalool and Nerolidyl Acetate in Acid Media T. M. Khomenko, L. E. Tatarova, D. V. Korchagina and V. A. Barkhash Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 36 . catathelasmol E C9H16O5 相似度:50% The Journal of Antibiotics 2009 62 239-242 Pentanol derivatives from basidiomycete Catathelasma imperiale and their 11-hydroxysteroid dehydrogenases inhibitory activity Ling Zhang, Yu Shen, Hua-Jie Zhu, Fei Wang, Ying Leng and Ji-Kai Liu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 37 . (±)-Endo,endo-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octane-5,8-diol diacetate C14H22O5 相似度:50% Natural Product Communications 2008 3 303-312 Synthesis and Antibacterial Activity of Highly Oxygenated1,8-Cineole Derivatives Margarita B. Villecco, Julieta V. Catalán, Marta I. Vega, Francisco M. Garibotto,Ricardo D. Enriz and César A. N. Catalán Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 38 . compound 44 相似度:50% Organic Magnetic Resonance 1975 7 426-432 13C-NMR-Spektren von Monoterpenen F. Bohlmann, R. Zeisberg and E. Klein Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 39 . Batyl alcohol 相似度:50% Chinese Journal of Organic Chemistry 1997 17 252-255 Studies on the chemical constituents of the soft coral Sarcophyton molle from South China Sea RAO Zhi-Gang, DENG Song-Zhi, LI Feng-Ying, WU Hou-Ming, SHI Zheng-Shuang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 40 . batyl alcohol 相似度:50% Acta Scientiarum Naturalium Universitatis Sunyatseni 2003 42(3) 105-107 Studies on the Secondary Metabolites of the Soft Coral, Sinularia sp. Collected from the South China Sea LAN Wen-jian, SU Jing-yu, ZENGLong-mei Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 41 . batyl alcohol 相似度:50% Acta Scientiarum Naturalium Universitatis Sunyatseni 1995 34(1) 110-113 The Chemical Constituents of Soft Coral Cladiella densa from South China Sea Wang Guiyangsheng, Liu Qing, Zeng Longmei Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- |
2楼2012-06-18 19:05:50
kaola0916
铁杆木虫 (著名写手)
- 应助: 173 (高中生)
- 金币: 6943.8
- 散金: 35
- 红花: 11
- 帖子: 1593
- 在线: 471.9小时
- 虫号: 856177
- 注册: 2009-09-25
- 专业: 药剂学
【答案】应助回帖
★ ★ ★ ★ ★
ilovepp: 金币+5 2012-07-12 08:53:04
ilovepp: 金币+5 2012-07-12 08:53:04
|
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 21.66,25.6,30.6,57.82,63.42,68.32,72.91,98.53,102.41,109.55,145.67,177.62 溶剂选项： 全部 CDCl3 CD3CD2OD CD2Cl2 C5D5N C3D7NO CD3SOCD3 C4D8O (CH3)4Si C4D8O2 CD3COOD C4D8O2 H2O D2O CF3COOD CD3OD ND3 CD3COCD3 C6D6 CD3CN 查询空值 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7个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . (2S)-5-{[(tert-Butyl)(dimethyl)silyl]oxy}-2-hydroxypentyl 4-Methylbenzenesulfonate 相似度:58.3% Helvetica Chimica Acta 2011 94 1226-1233 Asymmetric Total Synthesis of Stagonolide G Dasari Ramesh, Singanaboina Rajaram, Peddikotla Prabhakar, Udugu Ramulu, Dorigondla Kumar Reddy, and Yenamandra Venkateswarlu* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . Methyl-4,6-O-benzylidene-2,3-dideoxy-D-threo-hexopyranoside 相似度:50% Molecules 2005 10 871-883 Towards a Synthesis of Vigabatrin Using Glycal Chemistry S. Boga, J. Aidhen and I. Aidhen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . compound 8b 相似度:50% Tetrahedron Letters 2003 44 607-610 6-Chloro-2(2H)-pyranone: a new 2(2H)-pyranone synthon Matteo Biagetti, Fabio Bellina, Adriano Carpita, Renzo Rossi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . (2S)-2-Amino-1,3-dihydroxy-15-methylhexadecane C17H37NO2 相似度:50% Organic & Biomolecular Chemistry 2007 5 3826-3833 Structural confirmation of the dihydrosphinganine and fatty acid constituents of the dental pathogen Porphyromonas gingivalis JiYoung Mun, Amber Onorato, Frank C. Nichols, Martha D. Morton, Abdullah I. Saleh, Morgan Welzel and Michael B. Smith Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . (±)-(8R,8aR)-8-(4-chlorophenyl)-8-hydroxyhexahydroindolizin-3(5H)-one C14H16ClNO2 相似度:50% Tetrahedron 2012 68 3692-3700 Application of the intramolecular PIFA-mediated amidation of alkynes to the synthesis of substituted indolizidinones Original Research Article Leticia M. Pardo, Imanol Tellitu, Esther Domínguez Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . 6-vinyl-3β-hydroxy-2,2,6α-trimethyltetrahydropyran 相似度:50% Russian Journal of Organic Chemistry 2002 38 498-506 Rearrangements of Epoxides of Linalool and Nerolidyl Acetate in Acid Media T. M. Khomenko, L. E. Tatarova, D. V. Korchagina and V. A. Barkhash Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . compound 14b 相似度:50% The Journal of Antibiotics 1987 40 496-504 THE STRUCTURE OF INDUCING FACTORS FOR VIRGINIAMYCIN PRODUCTION IN STREPTOMYCES VIRGINIAS YASUHIRO YAMADA, KAZUHIRO SUGAMURA, KOICHI KONDO, MASAKATSU YANAGIMOTO, HIROSUKE OKADA Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- |
3楼2012-06-18 19:07:15