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去学吧银虫 (小有名气)
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[求助]
好心人呐，急求两个化合物的微谱数据。。。
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化合物1的碳的化学位移，用氘代甲醇溶的： 102.0,116.5,132.7,144.0,153.8,167.8 化合物2的碳的化学位移，用氘代甲醇溶的： 14.3,23.5,32.6,34.8,78.6,127.6,146.0,152.8,153.6,172.5 |
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- 急求微谱数据库查询
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tianhenlanqi
新虫 (小有名气)
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【答案】应助回帖
感谢参与，应助指数 +1
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化合物1 查询结果：共查到73个化合物(查询结果仅供参考) 1 . N-(4-cyanophenyl)-N'-[(sodiosulfo)methyl]urea C9H8N3O4NaS 相似度:71.4% Journal of Medicinal Chemistry 1992 35 1747-1751 Carboxylic acid replacement structure-activity relationships in suosan type sweeteners. A sweet taste antagonist. 1 George W. Muller, J. Chris Culberson, Glenn Roy, Jeanette Ziegler, D. Eric Walters, Michael S. Kellogg, Susan S. Schiffman, Zoe S. Warwick Structure 13C NMR 碳谱模拟图 2 . pyrimidine-2,4-dione (uracil) C4H4N2O2 相似度:66.6% Phytochemistry 1999 50 337-338 A complex of 5-hydroxypyrrolidin-2-one and pyrimidine-2,4-dione isolated from Jatropha curcas Ruth Staubmann, Manfred Schubert-Zsilavecz, Alois Hiermann,Theodor Kartnig Structure 13C NMR 碳谱模拟图 3 . uracil 相似度:66.6% Chinese Traditional and Herbal Drugs 2010 41 1771-1773 Chemical constituents in n-butanol extract of Abelmoschus esculentusl JIA Lu; LI Huan-fen; JING Lin-lin Structure 13C NMR 碳谱模拟图 4 . Benzidine-3,3'-dicarboxylic Acid 相似度:57.1% Helvetica Chimica Acta 2009 92 2675-2697 Polymeric Colorants: Statistical Copolymers of Indigo Building Blocks with Defined Structures Gundula Voss, Markus Drechsler, Steffen Eller, Michael Gradzielski, Daniel Gunzelmann, Svastik Mondal, Sander van Smaalen, Claus S. Voertler Structure 13C NMR 碳谱模拟图 5 . toyocamycin aglycone 相似度:57.1% Journal of Natural Products 1989 Vol 52 1353 The Isolation and Structure of Modified Bioactive Nucleosides from Jaspis johnstoni T. Mark Zabriskie, Chris M. Ireland Structure 13C NMR 碳谱模拟图 6 . Methyl-4-hydroxybenzoate 相似度:50% Chemistry of Natural Compounds 2008 44 368-369 FLAVONOIDS AND PHENOLIC COMPOUNDS FROM SEEDS OF THE CHINESE PLANT Nigella glandulifera X. L. Xin, H. A. Aisa, and H. Q. Wang Structure 13C NMR 碳谱模拟图 7 . compound 18 相似度:50% Helvetica Chimica Acta 1981 64 1672-1681 Structure Determination of Brominated Morphinan-6-ones by 13C-NMR. Spectroscopy: A novel closure of the oxygen bridge using 4-acetoxymorphinan-6-ones Arnold Brossi, Fu-Lian Hsu, Kenner C. Rice, Maria D. Rozwadowska, Helmut Schmidhammer, Charles D. Hufford, Chian Chian Chiang, Isabella L. Karle Structure 13C NMR 碳谱模拟图 8 . compound 20 相似度:50% Helvetica Chimica Acta 1981 64 1672-1681 Structure Determination of Brominated Morphinan-6-ones by 13C-NMR. Spectroscopy: A novel closure of the oxygen bridge using 4-acetoxymorphinan-6-ones Arnold Brossi, Fu-Lian Hsu, Kenner C. Rice, Maria D. Rozwadowska, Helmut Schmidhammer, Charles D. Hufford, Chian Chian Chiang, Isabella L. Karle Structure 13C NMR 碳谱模拟图 9 . p-hydroxyl-benzoic acid 相似度:50% China Journal of Chinese Materia Medica 2006 31 1436-1441 Studies on chemical constituents of Paederia scandense ZOU Xu, LIANG Jian, DING Lisheng, PENG Shulin Structure 13C NMR 碳谱模拟图 10 . 2,5-dimethoxy-dimethylterephthalate C12H14O6 相似度:50% Journal of Natural Products 1988 Vol 51 977 Monohydroxy- and 2,5-Dihydroxy Terephthalic Acids, Two Unusual Phenolics Isolated from Centaurium erythraea and Identified in Other Gentianaceae Members Marianna Hatjimanoli, Jean Favre-Bonvin, Mourad Kaouadji, Anne-Marie Mariotte Structure 13C NMR 碳谱模拟图 11 . pisolithin A 相似度:50% Phytochemistry 1991 30 1113-1118 Antifungal antibiotics from Pisolithus tinctorius Youla S. Tsantrizos, Harry H. Kope, J.André Fortin, Kelvin K. Ogilvie Structure 13C NMR 碳谱模拟图 12 . 5-Cyano-6-morpholinopyrazine-2-carboxamide C10H11N5O2 相似度:50% Bioorganic & Medicinal Chemistry 2011 19 1471-1476 Synthesis and antimycobacterial properties of N-substituted 6-amino-5-cyanopyrazine-2-carboxamides Jan Zitko, Martin Dolezal, Michaela Svobodova, Marcela Vejsova, Jiri Kunes,Radim Kucera, Petr Jilek Structure 13C NMR 碳谱模拟图 13 . 4-Acetoxy phenol 相似度:50% Bioorganic & Medicinal Chemistry 2011 19 2168-2175 Synthesis and anti-melanogenic activity of hydroxyphenyl benzyl ether analogues Kiran Sapkota, Eunmiri Roh, Eunyoung Lee, Eun-Mi Ha, Jae-Ho Yang, Eung-Seok Lee,Youngjoo Kwon, Youngsoo Kim, Younghwa Na Structure 13C NMR 碳谱模拟图 14 . P-hydroxybenzoic acid C7H6O3 相似度:50% Molecules 2011 16 6179-6192 Antioxidant Activity of Papaya Seed Extracts Kaibing Zhou, Hui Wang, Wenli Mei, Xiaona Li, Ying Luo 1 and Haofu Dai Structure 13C NMR 碳谱模拟图 15 . 4-Chloro-phenylcyanonitromethane potassium nitronate C8H4ClN2O2 相似度:50% Canadian Journal of Chemistry 2011 89 130–138 Photogeneration and reactivity of acyl nitroso compounds Anthony S. Evans, Andrew D. Cohen, Zachary A. Gurard-Levin, Naod Kebede, Tevye C. Celius, Alexander P. Miceli, and John P. Toscano Structure 13C NMR 碳谱模拟图 16 . 3-(4-fluorophenyl)-3-oxopropanal semicarbazone C10H10FN3O2 相似度:50% Chemical & Pharmaceutical Bulletin 2010 58 1127-1131 Design, Synthesis and Biological Evaluation of 3-(4-Halophenyl)-3-oxopropanal and Their Derivatives as Novel Antibacterial Agents Jinbing Liu, Wei Yi, Jianming Hu, Fengyan Wu, Liangzhong Zhao, Huacan Song and Zhihou Wang Structure 13C NMR 碳谱模拟图 17 . N-(4-bromophenyl)-4-methylfuroxan-3-sulfonamide C9H8BrN3O4S 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 18 . 6-nitrothiazolo[5,4-b]pyridine-2-amine 相似度:50% Journal of Heterocyclic Chemistry 2009 46 1125-1131 A single-step preparation of thiazolo[5,4-b]pyridine-and thiazolo[5,4-c]pyridine derivatives from chloronitropyridines and thioamides,or thioureas Kiran P. Sahasrabudhe,M. Angels Estiarte,Darlene Tan,Sheila Zipfel,Matthew Cox,Donogh J. R. O'Mahony,William T. Edwards and Matthew A. J. Duncton Structure 13C NMR 碳谱模拟图 19 . 6-bromothiazolo[5,4-b]pyridin-2-amine 相似度:50% Journal of Heterocyclic Chemistry 2009 46 1125-1131 A single-step preparation of thiazolo[5,4-b]pyridine-and thiazolo[5,4-c]pyridine derivatives from chloronitropyridines and thioamides,or thioureas Kiran P. Sahasrabudhe,M. Angels Estiarte,Darlene Tan,Sheila Zipfel,Matthew Cox,Donogh J. R. O'Mahony,William T. Edwards and Matthew A. J. Duncton Structure 13C NMR 碳谱模拟图 20 . 3,5,6-trichloro-N-methylpyridazin-4-amine C5H4Cl3N3 相似度:50% Journal of Heterocyclic Chemistry 2008 45 143-147 Reactions of tetrachloropyridazine with aliphatic nitrogen nucleophiles Graham Pattison,Graham Sandford,Emma V.B. Wallace,Dmitry S. Yufit,Judith A.K. Howard,John A. Christopher and David D. Miller Structure 13C NMR 碳谱模拟图 21 . 3-nitropyridine-4-carbonyl azide 相似度:50% Journal of Heterocyclic Chemistry 2005 42 259-264 Nitropyridyl isocyanates Jarle Holt,Trygve Andreassen,Jan M. Bakke and Anne Fiksdahl Structure 13C NMR 碳谱模拟图 |
2楼2013-03-02 16:06:20
tianhenlanqi
新虫 (小有名气)
- 应助: 54 (初中生)
- 金币: 1257
- 红花: 5
- 帖子: 156
- 在线: 11.3小时
- 虫号: 1280112
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- 性别: MM
- 专业: 中药药效物质
【答案】应助回帖
★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
去学吧: 金币+30, ★★★很有帮助 2013-03-02 20:38:57
去学吧: 金币+30, ★★★很有帮助 2013-03-02 20:38:57
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化合物2 查询结果：共查到81个化合物(查询结果仅供参考) 1 . (-)-massoialactone C10H16O2 相似度:60% Canadian Journal of Chemistry 2009 87 650-661 Chiral α-substituted allylboronates in a one-potthree-component asymmetric allylic alkylation/carbonyl allylation reaction sequence -Applications to the syntheses of (+)-(3R,5R)-3-hydroxy-5-decanolide and (-)-massoialactone Lisa Carosi and Dennis G. Hall Structure 13C NMR 碳谱模拟图 2 . compound 4 C154H258Cl4N4O9 相似度:60% Tetrahedron Letters 2005 46 8845-8848 Calix[8]arene anions: solid state structure of an inclusion compound with a tetrabutylammonium cation Paulina R. Martínez-Alanis, Ivan Castillo Structure 13C NMR 碳谱模拟图 3 . compound 17a 相似度:60% Zeitschrift für Naturforschung B 2007 62 1174-1182 Triethylborane: An "Old" Reagent with New Functions. 1,2-Hydroboration B. Wrackmeyer, E. Khan, S. Bayer, and K. Shahid Structure 13C NMR 碳谱模拟图 4 . (5R,3Z) 5-Hydroxydec-3-enoic acid 相似度:60% Natural Product Communications 2009 4 389-394 Aureobasidin, New Antifouling Metabolite fromMarine-Derived Fungus Aureobasidium sp. Ahmed Abdel-Lateff1, Ehab S. Elkhayat2, Mostafa A. Fouad1 and Tatsufumi Okino3 Structure 13C NMR 碳谱模拟图 5 . (3S,5S)-3-Azido-5-hexyldihydrofuran-2-one C10H17N3O2 相似度:60% Tetrahedron 2012 68 5396-5405 Stereoselective synthesis of cis- or trans-2,4-disubstituted butyrolactones from Wynberg lactone Ashok Ganta, Julia L. Shamshina, Lauren R. Cafiero, Timothy S. Snowden Structure 13C NMR 碳谱模拟图 6 . 3-[4-(3-chloropropyl)-5-methylfuran-2-yl]propanamide C11H16O2NCl 相似度:54.5% Journal of Heterocyclic Chemistry 2006 43 223-228 Application on novel fragmentation reaction: A concise synthesis of 2,3,5-trisubstituted furans from butenolides Xuqing Zhang,Elieen U. Jackson and Arthur G. Schultz Structure 13C NMR 碳谱模拟图 7 . compound 20b 相似度:54.5% Zeitschrift für Naturforschung B 2007 62 1174-1182 Triethylborane: An "Old" Reagent with New Functions. 1,2-Hydroboration B. Wrackmeyer, E. Khan, S. Bayer, and K. Shahid Structure 13C NMR 碳谱模拟图 8 . (1S,4S)-4-acetoxy-2-methyl-cyclopent-2-enecarboxylic acid ethyl ester C11H16O4 相似度:54.5% Bioorganic & Medicinal Chemistry 2008 16 374-381 Chemoenzymatic synthesis and antiviral evaluation of conformationally constrained and 3'-methyl-branched carbanucleosides using both enantiomers of the same building block Yoann Aubin, Gérard Audran, Honoré Monti, Erik De Clercq Structure 13C NMR 碳谱模拟图 9 . 3,7-dimethylguanine C7H9N5O 相似度:50% Chemical & Pharmaceutical Bulletin 2001 49(12) 1628-1630 3,7-Dimethylguanine, a New Purine from a Philippine Sponge Zyzzya fuliginosa Deniz TASDEMIR,Gina C. MANGALINDAN,Gisela P. CONCEPCIóN,Mary Kay HARPER,and Chris M. IRELAND Structure 13C NMR 碳谱模拟图 10 . compound 2a/2b C12H18O2 相似度:50% Journal of Natural Products 2008 71(10) 1726-1731 Glucosylated Suspensosides, Water-Soluble Pheromone Conjugates from the Oral Secretions of Male Anastrepha suspensa Spencer S. Walse, Fang Lu, and Peter E. A. Teal Structure 13C NMR 碳谱模拟图 11 . 1,3,7-trimethylguanine 相似度:50% Journal of Natural Products 2001 64 1100-1101 A Novel Modified Pterin from a Eudistoma Species Ascidian Ryan M. Van Wagoner,Jamaluddin Jompa, Akbar Tahir, and Chris M. Ireland Structure 13C NMR 碳谱模拟图 12 . multiflotriol C10H14O3 相似度:50% Phytochemistry 2000 55 933-936 Chemistry of Zataria multiˉora (Lamiaceae) Muhammad Shaiq Ali, Muhammad Saleem, Zulfiqar Ali, Viqar Uddin Ahmad Structure 13C NMR 碳谱模拟图 13 . (5S)-decan-5-olide 相似度:50% Chemical & Pharmaceutical Bulletin 1990 38 2381-2389 Structure Elucidation of Glycosidic Antibiotics, Glykenins, from Basidiomycetes sp. II. : Absolute Structures of Unusual Polyhydroxylated C26-Fatty Acids, Aglycones of Glykenins Fumiko NISHIDA,Yuji MORI,Naoko ROKKAKU,Sayuri ISOBE,Takeyuki FURUSE,Makoto SUZUKI,Vithaya MEEVOOTISOM,Timothy W. FLEGEL,Yodhathai THEBTARANONTH and Suthum INTARARUANGSORN Structure 13C NMR 碳谱模拟图 14 . (4R,6R)-4-(Iodomethyl)-6-pentyl-1,3-dioxan-2-one C10H17IO3 相似度:50% Helvetica Chimica Acta 2009 92 1840-1844 A Stereoselective Total Synthesis of Verbalactone Biswanath Das, Keetha Laxminarayana, Martha Krishnaiah, Duddukuri Nandan Kumar Structure 13C NMR 碳谱模拟图 15 . compound 2 相似度:50% Chinese Chemical Letters 2007 18 1443-1446 Oxidative aromatization of Hantzsch 1,4-dihydropyridines by aqueous hydrogen peroxide-acetic acid Zong Yuan Chen a，Wei Zhang Structure 13C NMR 碳谱模拟图 16 . 2,5-dipentadecyl-1,3,4-oxadiazole C32H62ON2 相似度:50% Chinese Chemical Letters 2008 19 2010-5-8 One-pot synthesis, antibacterial and antifungal activities of n o ve l 2 ,5 -disubstituted-1,3,4 oxadiazoles Abdul Rauf，Shweta Sharma, Saloni Gangal Structure 13C NMR 碳谱模拟图 17 . 2,5-diheptadecyl-1,3,4-oxadiazole C36H70ON2 相似度:50% Chinese Chemical Letters 2008 19 2010-5-8 One-pot synthesis, antibacterial and antifungal activities of n o ve l 2 ,5 -disubstituted-1,3,4 oxadiazoles Abdul Rauf，Shweta Sharma, Saloni Gangal Structure 13C NMR 碳谱模拟图 18 . Ethyl (Z)-3-[5-formyl-(2-furyl)]-2-[5-formyl-(2-thienyl)]acrylate C15H12O5 相似度:50% Molecules 2002 7 871-884 Synthesis of Some New bis-(p-Fluorophenyl)amides of the Thieno[3, 2-b]thiophene, Thieno[3, 2-b]furan and 1, 2-bis{5-[2-(2-Thienyl)ethenyl]2-thienyl}ethene Series Davorka Pavlicic, Jasna D. Koružnjak, Zrinka Banic-Tomišic and Grace Karminski-Zamola Structure 13C NMR 碳谱模拟图 19 . jatamanin F C10H16O4 相似度:50% Journal of Natural Products 2010 73 632-638 Iridoids and Lignans from Valeriana jatamansi Sheng Lin, Tao Chen, Xiao-Hua Liu, Yun-Heng Shen, Hui-Liang Li, Lei Shan, Run-Hui Liu, Xi-Ke Xu, Wei-Dong Zhang and Hui Wang Structure 13C NMR 碳谱模拟图 20 . 1,3,7-trimethylguanine C8H15N5O 相似度:50% Journal of Natural Products 1987 Vol 50 307 1,3,7-Trimethylguanine from the Sponge Latrunculia brevis Nigel B. Perry, John W. Blunt, Murray H. G. Munro Structure 13C NMR 碳谱模拟图 21 . α-Monopalmitin 相似度:50% Chemistry of Natural Compounds 2011 Vol. 47, No. 2 303-305 MONOTERPENES AND OTHER CHEMICAL CONSTITUENTS FROM THE AERIAL PARTS OF Inula japonica Jia Xian Zhu,Jiang Jiang Qin,He Ran Wang,Yan Zhu,Wei Dong Zhang,and Hui Zi Jin Structure 13C NMR 碳谱模拟图 22 . (R)-5-butyltetrahydrofuran-2-ol(Major isomer) C8H16O2 相似度:50% Organic Letters 2007 Vol. 9, No. 10 1975-1978 Ene-yne Tetrahydrofurans from the Sponge Xestospongia muta. Exploiting a Weak CD Effect for Assignment of Configuration Brandon I. Morinaka, Colin K. Skepper, and Tadeusz F. Molinski Structure 13C NMR 碳谱模拟图 |
3楼2013-03-02 16:07:03