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何紫菀

银虫 (小有名气)

[求助] 求助微谱数据查询~~谢谢啦O(∩_∩)O

碳谱数据(氘代氯仿)
29.3,32.2,34.6,39.6,53.6,56.4,68.4,120.4,120.9,125.0,125.1,126.7,126.9,127.2,127.3,128.7,128.8,129.0,131.3,131.7,132.3,132.7,135.0,135.7,135.9,136.5,166.2,168.6,170.3,171.8
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人生如萍聚散无常,何须朝朝暮暮盼望……
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sphwxl

新虫 (初入文坛)

引用回帖:
2楼: Originally posted by wangkaibo123 at 2013-11-06 19:22:09
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 ...

您好!能否帮忙查两个碳谱呢?
3楼2019-08-13 16:02:43
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查看全部 3 个回答

wangkaibo123

荣誉版主 (职业作家)

kerry

优秀版主

【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与,应助指数 +1
何紫菀: 金币+15, ★★★★★最佳答案, 感谢回帖~~ 2013-11-06 21:32:31
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1255个化合物(查询结果仅供参考)
1 .     1,4-benzodiazepine-2,5-diones
C17H16N2     相似度:96.6%
Chinese Journal of Marine Drugs          2006          25(6)          1-6
Antitumor components from sponge-derived fungus Penicillium auratiogriseum Sp-19
XIN Zhi-hong, FANG Yu-chun, ZHU Tian-jiao, DUAN Lin, GU Qian-qun, ZHU Wei-ming
Structure      13C NMR   碳谱模拟图
2 .     compound 12
    相似度:87.8%
Journal of Natural Products          1995          Vol 58          1570-1574
Triterpenoids from the Aerial Parts of Lantana camara
Sabira Begum, Syed Mohammad Raza, Bina Shaheen Siddiqui, Salimuzzaman Siddiqui
Structure      13C NMR   碳谱模拟图
3 .     1-[(2-bromophenyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxaldehyde
    相似度:65.6%
Bioorganic & Medicinal Chemistry          2013          21          779-787
Alkaloid constituents from flower buds and leaves of sacred lotus (Nelumbo nucifera, Nymphaeaceae) with melanogenesis inhibitory activity in B16 melanoma cells
Seikou Nakamura, Souichi Nakashima, Genzo Tanabe, Yoshimi Oda, Nami Yokota, Katsuyoshi Fujimoto, Takahiro Matsumoto, Rika Sakuma, Tomoe Ohta, Keiko Ogawa, Shino Nishida, Hisako Miki, Hisashi Matsuda, Osamu Muraoka, Masayuki Yoshikawa
Structure      13C NMR   碳谱模拟图
4 .     (2R,S)-3-(4-Benzyloxy-phenyl)-2-{2-[(1H-indole-2-carbonyl)-amino]-benzoylamino}-propionic acid benzyl ester
    相似度:64.5%
Bioorganic & Medicinal Chemistry          2009          17          2336-2350
Anthranilic acid based CCK1 receptor antagonists: Blocking the receptor with the same ‘words’ of the endogenous ligand
Lucia Lassiani, Michela V. Pavan, Federico Berti, George Kokotos, Theodoros Markidis, Laura Mennuni, Francesco Makovec, Antonio Varnavas
Structure      13C NMR   碳谱模拟图
5 .     (4Z,9Z,15Z)-1,21-Dihydro-19-methoxy-5,10,15-triphenyl-23H-bilin-1-one
C38H28O2N4     相似度:64.5%
The Journal of Organic Chemistry          2012          77          6510-6519
Synthesis, Reactivity, and Spectroscopic Properties of meso-Triaryl-5-oxaporphyrins
Kazuhisa Kakeya, Aya Nakagawa, Tadashi Mizutani, Yutaka Hitomi, and Masahito Kodera
Structure      13C NMR   碳谱模拟图
6 .     Dimethyl-6d,12b-dihydro-cyclopropa[3,4]pentaleno-[1,2-a;6,5-c']dinaphthalene-6c,12d-dicarboxylate
C28H20O4     相似度:63.3%
Canadian Journal of Chemistry          2009          87          619-626
Controlling the regioselectivity of the di-p-methane rearrangements of 1,2-naphtho-annelated barrelene derivatives -Solution versus solid-state photochemistry
Jia Luo, Heiko Ihmels, Hans-Jo¨ rg Deiseroth, and Marc Schlosser
Structure      13C NMR   碳谱模拟图
7 .     compound (S,S)-1e
C39H39N3O3     相似度:63.3%
Heterocycles          2006          68          1571-1578
Preferred Conformations of Diastereomeric N-Acyl-1-naphthylalanylprolinamides and Related Dipeptides and Their Fluorescence Quenching by Chiral Amines
Hiroki Kurosawa, Kana Bakoshi, Shozo Ichikawa, Tetsutaro Igarashi, and Tadamitsu Sakurai*
Structure      13C NMR   碳谱模拟图
8 .     Compound 4h
    相似度:63.3%
Bioorganic & Medicinal Chemistry Letters          2004          14          5813-5816
Design, synthesis, and evaluation of hexahydrobenz[f]isoquinolines as a novel class of dopamine 3 receptor ligands
Xihan Wu, Jianyong Chen, Min Ji, Judith Varady, Beth Levant, Shaomeng Wang
Structure      13C NMR   碳谱模拟图
9 .     4-(N,S-bis-Benzyloxycarbonylcysteinylaminomethyl)-N-(2,3-dimethylphenyl)-trans-cyclohexylcarboxamide
C35H41N3O6S     相似度:63.3%
Archiv der Pharmazie          1999          332          124-132
Different Amino Acid Replacements in CAAX-Tetrapeptide Based Peptidomimetic Farnesyltransferase Inhibitors
Martin Schlitzer, Isabel Sattler and Hans-Martin Dahse
Structure      13C NMR   碳谱模拟图
10 .     1-(3-(2-(7-Chloroquinolin-2-yl)ethenyl)phenyl)-3-(3-iodo-5-(3-trifluoromethyl-3H-diazirin-3-yl)phenyl)-S-propan-1-ole
C28H20ClF3IN3O     相似度:63.3%
Bioorganic & Medicinal Chemistry          1998          6          63-72
A novel photoaffinity probe for the LTD4 receptor
Michel Gallant, Nicole Sawyer, Kathleen M. Metters, Robert J. Zamboni
Structure      13C NMR   碳谱模拟图
Domyallbesttohaveahappylife.
2楼2013-11-06 19:22:09
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