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夏天的雪2359

铁杆木虫 (著名写手)

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[求助] 求助微谱数据

氘代氯仿;
55.9,61.1,104.1,115.6,115.7,126.2,137.1,142.3,182.3
3Q!
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jasminelw

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【答案】应助回帖

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感谢参与,应助指数 +1
夏天的雪2359: 金币+30, ★★★★★最佳答案, 谢谢,结果还真不好。呵呵 2013-05-04 16:14:56
貌似结果不好。。。
查询结果:共查到541个化合物(查询结果仅供参考)  
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1 .     2,7-dibromo-3,6,9,10-tetramethoxyphenanthrene
C18H16O4Br2     相似度:66.6%
Canadian Journal of Chemistry          2008          86          50-64
New diformyldihydroxyaromatic precursors for luminescent Schiff base macrocycles: Synthesis,characterization, and condensation studies
Britta N. Boden, Amir Abdolmaleki, Cecily T.-Z. Ma, and Mark J. MacLachlan
Structure      13C NMR   碳谱模拟图

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2 .     2-(4-methoxybenzyl)-2,3-dihydro-1H-isoindole
C16H17NO     相似度:66.6%
Indian Journal of Chemistry          2009          48B          545-552
An efficient method for the synthesis of 2,3-dihydro-1H-isoindoles
Subbarayappa,Adimurthy; Patoliya,Paresh U
Structure      13C NMR   碳谱模拟图

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3 .     compound 20
    相似度:66.6%
Heterocycles          2005          65          1481-1490
Ring Transformation of Dimethoxybenzenes to Heterocycles by Ozonolysis
Yuki Yoshida,* Satoshi Ichikawa, Yuka Shinozuka, Mitsuru Satoh, Kunihiko Mohri, and Kimiaki Isobe
Structure      13C NMR   碳谱模拟图

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4 .     1,7-bis(4-hydroxy-3,5-dimethoxyphenyl)-1,6-heptadiene-3,5-dione
    相似度:66.6%
Food Chemistry          2010          119          1435-1442
Antioxidant capacity of curcumin-directed analogues: Structure–activity relationship and influence of microenvironment
Ya-Jing Shang, Xiao-Ling Jin, Xian-Ling Shang, Jiang-Jiang Tang, Guo-Yun Liu, Fang Dai, Yi-Ping Qian, Gui-Juan Fan, Qiang Liu, Bo Zhou
Structure      13C NMR   碳谱模拟图

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5 .     5,5,5-trifluoro-4-(p-fluorophenylamino)pentan-1-ol
C11H13F4NO     相似度:66.6%
European Journal of Organic Chemistry          2010                   1778-1786
Reductive Amination/Cyclization of ω-Trifluoromethyl Keto Esters to Trifluoromethylated δ-Amino Alcohols and Lactams
Wen Wan, Jie Hou, Haizhen Jiang, Zongqian Yuan, Goubin Ma, Gang Zhao and Jian Hao
Structure      13C NMR   碳谱模拟图

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6 .     5-methoxy-2-nitrobenzyl chloride
C8H8ClNO3     相似度:66.6%
Journal of Medicinal Chemistry          1996          39          1084-1094
Hypoxia-Selective Antitumor Agents. 12. Nitrobenzyl Quaternary Salts as Bioreductive Prodrugs of the Alkylating Agent Mechlorethamine
Moana Tercel, William R. Wilson, Robert F. Anderson, and William A. Denny
Structure      13C NMR   碳谱模拟图

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7 .     3-bromo-5-hydroxy-4-methoxyphenylalanine
C10H11BrNO4     相似度:60%
Journal of Natural Products          2007          70          337-341
Bromophenols Coupled with Nucleoside Bases and Brominated Tetrahydroisoquinolines from the Red Alga Rhodomela conferWoides
Ming Ma, Jielu Zhao,Sujuan Wang, Shuai Li, Yongchun Yang, Jiangong Shi,Xiao Fan, and Lan He
Structure      13C NMR   碳谱模拟图

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8 .     ethyl p-methoxy-trans-cinnamate
C12H14O3     相似度:60%
Chemical & Pharmaceutical Bulletin          1985          33          5565-5567
Studies on Anticancer Principles in Chinese Medicines. II. Cytotoxic Principles in Biota orientalis (L.) ENDL. and Kaempferia galanga L.
TAKUO KOSUGE,MASAMI YOKOTA,KIYOSHI SUGIYAMA,MASASHI SAITO,YURIKO IWATA,MOTOO NAKURA and TOSUKE YAMAMOTO
Structure      13C NMR   碳谱模拟图

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9 .     ethyl p-methoxy-trans-cinnamate
C12H14O3     相似度:60%
Chemical & Pharmaceutical Bulletin          1983          31          2708-2711
Monoamine Oxidase Inhibitor from the Rhizomes of Kaempferia galanga L.
TADATAKA NORO,TOSHIO MIYASE,MASANORI KUROYANAGI,AKIRA UENO and SEIGO FUKUSHIMA
Structure      13C NMR   碳谱模拟图

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10 .     compound 29
    相似度:60%
Molecules          2004          9          405-426
Synthesis of Chiral Building Blocks for Use in Drug Discovery
Sharon T. Marino, Danuta Stachurska-Buczek, Daniel A. Huggins, Beata M. Krywult, Craig S. Sheehan, Thao Nguyen, Neil Choi, Jack G. Parsons, Peter G. Griffiths, Ian W. James, Andrew M. Bray, Jonathan M. White and Rustum S. Boyce
Structure      13C NMR   碳谱模拟图

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11 .     Methyl 3,5-dihydroxy-4-ethoxycinnamate
    相似度:60%
Biochemical Systematics and Ecology          2007          35          456-458
Alkaloids and a new cinnamate derivative from Duguetia gardneriana
Jackson Roberto Guedes da Silva Almeida, Ana Sílvia Suassuna Carneiro Lúcio, José Maria Barbosa-Filho, Maria de Fátima Agra, Marcelo Sobral da Silva, Emidio Vasconcelos L. da Cunha, Daniel Esdras de Andrade Uchoa, Raimundo Braz-Filho
Structure      13C NMR   碳谱模拟图

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12 .     ethyl p-methoxycinnamate
    相似度:60%
Acta Pharmaceutica Sinica          2002          Vol 37          348-351
STUDIES ON THE CHEMICAL CONSTITUENTS OF SECURIDACA INAPPENDICULATA
YANG Xue dong; XU Li zhen; YANG Shi lin
Structure      13C NMR   碳谱模拟图

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13 .     2-(5-Bromo-1H-indol-3-yl)-2-(hydroxyamino)ethanamine dihydrochloride
    相似度:60%
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

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14 .     2-(6-Bromo-1H-indol-3-yl)-2-(hydroxyamino)ethanamine dihydrochloride
    相似度:60%
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

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15 .     compound 17
    相似度:60%
Magnetic Resonance in Chemistry          2011          49          537-542
Complete assignment of NMR data of 22 phenyl-1H-pyrazoles’ derivatives
Aline Lima de Oliveira, Carlos Henrique Alves de Oliveira,LauraMaiaMairink, Francine Pazini, RicardoMenegattib and Luciano Morais Lião
Structure      13C NMR   碳谱模拟图

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16 .     5(4'-Methoxyphenyl)-pyrazolidine-3,3,4,4-tetracarbonitrile
C14H10N6O     相似度:60%
Canadian Journal of Chemistry          2005          83          57-62
New cycloaddition of diarylazines with 1,2-dehydrobenzene, 1,1,2,2-tetracyanoethylene, and dibenzoylacetylene-Facile synthesis of acridinones, pyrazolidine, and pyridazine derivatives
Ashraf A. Aly and Mohsen A.-M. Gomaa
Structure      13C NMR   碳谱模拟图

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17 .     N-[(Z)-2-amino-1,2-dicycanovinylcarbamoyl]-p-toluenesulfonamide
    相似度:60%
Journal of Heterocyclic Chemistry          2001          38          939-944
A new synthesis of 4-cyano-1,3-dihydro-2-oxo-2H-imidazole-5-(N1-tosy1)carboxamide : reactive precursor for thiopurine analogues
Abdel-Sattar S. Hamad and Hamed D. A. Y. Derbala
Structure      13C NMR   碳谱模拟图

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18 .     5-chloro-2-methoxy[1,2,4]triazolo[1,5-a]quinazoline
C10H7ClN4O     相似度:60%
Heterocycles          2010          81          1843-1859
Novel Synthesis of 2-Alkoxy(Aralkoxy)-5-chloro[1,2,4]triazolo[1,5-a]quinazolines and Their Derivatives
Rashad Al-Salahi and Detlef Geffken
Structure      13C NMR   碳谱模拟图

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19 .     (E)-3-(4-Methoxyphenyl)acrylic acid ethyl ester
    相似度:60%
Molecules          2010          15          315-330
Palladium(II)/Cationic 2,2’-Bipyridyl System as a Highly Efficient and Reusable Catalyst for the Mizoroki-Heck Reaction in Water
Shao-Hsien Huang, Jun-Rong Chen and Fu-Yu Tsai
Structure      13C NMR   碳谱模拟图

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20 .     2-allyl-3-methoxyphenol
C10H12O2     相似度:60%
Heterocycles          2002          57          1997-2010
A New Synthesis of Substituted 2,5-Dihydrobenzooxepines
Eng-Chi Wang,* Ming-Kun Hsu, Yu-Li Lin, and Keng-Shiang Huang
Structure      13C NMR   碳谱模拟图

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21 .     N-{[(Z)-2-amino-1,2-dicyanovinyl]amino}carbonyl]-4-methylbenzenesulfonamide
C12H11N5O3S     相似度:60%
Bioorganic & Medicinal Chemistry          2010          18          7639-7650
A convenient synthesis and molecular modeling study of novel purine and pyrimidine derivatives as CDK2/cyclin A3 inhibitors
Abdel-Sattar S. Hamad Elgazwy, Nasser S.M. Ismail, Heba S.A. Elzahabi
Structure      13C NMR   碳谱模拟图

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22 .     compound 18
C19H14N2O2Se     相似度:60%
Bioorganic & Medicinal Chemistry          2009          17          1648-1653
Synthesis and biological evaluation of fused thio- and selenopyrans as new indolocarbazole analogues with aryl hydrocarbon receptor affinity
Emma Wincent, Hamid Shirani, Jan Bergman, Ulf Rannug, Tomasz Janosik
Structure      13C NMR   碳谱模拟图

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23 .     5-chloro-2-methoxy[1,2,4]triazolo[1,5-a]quinazoline
C10H7ClN4O     相似度:60%
Journal of Heterocyclic Chemistry          2011          48          656-662
Synthesis of novel 2-alkoxy(aralkoxy)-4H-[1,2,4]triazolo[1,5-a]quinazolin-5-ones starting with dialkyl-N-cyanoimidocarbonates
Rashad Al-Salahi and Detlef Geffken
Structure      13C NMR   碳谱模拟图

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24 .     diethyl 2,2'-(biphenyl-4,4'-diyldihydrazono)bis-(4,4,4-trifluoro-3-oxobutanoate)
C24H20F6N4O6     相似度:60%
Russian Journal of Organic Chemistry          2007          43          1781-1787
Synthesis, structure, and complexing ability of fluoroalkyl-containing 2,2′-(biphenyl-4,4′-diyldihydrazono)bis(1,3-dicarbonyl) compounds
I. V. Shchur, O. G. Khudina, Ya. V. Burgart, V. I. Saloutin and M. A. Grishina, et al.
Structure      13C NMR   碳谱模拟图

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25 .     (E)-ethyl-3-(4-methoxyphenyl)acrylate
    相似度:60%
Tetrahedron          2012          68          6498-6503
Nucleophilic carbene-catalyzed redox-esterification reaction of α-halo-α,β-unsaturated aldehyde
Xiang-Bo Wang, Xiao-Lei Zou, Guang-Fen Du, Zhi-Yong Liu, Bin Dai
Structure      13C NMR   碳谱模拟图

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26 .     5,5,5-trifluoro-4-(p-methoxyphenylamino)pentan-1-ol
C12H16F3NO2     相似度:60%
European Journal of Organic Chemistry          2010                   1778-1786
Reductive Amination/Cyclization of ω-Trifluoromethyl Keto Esters to Trifluoromethylated δ-Amino Alcohols and Lactams
Wen Wan, Jie Hou, Haizhen Jiang, Zongqian Yuan, Goubin Ma, Gang Zhao and Jian Hao
Structure      13C NMR   碳谱模拟图

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27 .     1,5-bis(3-methoxyphenyl)-1,4-pentadien-3-one
C19H18O3     相似度:60%
European Journal of Organic Chemistry          2010                   120-133
Synthesis of Rotationally Restricted and Modular Biphenyl Building Blocks
David Vonlanthen, Jürgen Rotzler, Markus Neuburger and Marcel Mayor
Structure      13C NMR   碳谱模拟图

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28 .     Ethyl 4-Methoxy-trans-cinnamate
    相似度:60%
Journal of Agricultural and Food Chemistry          1993          41          153-156
Potential anticarcinogenic natural products isolated from lemongrass oil and galanga root oil
Guo Qiang. Zheng, Patrick M. Kenney, Luke K. T. Lam
Structure      13C NMR   碳谱模拟图

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29 .     3-Methylene-1-(4-methoxyphenyl)-4-pentenol
    相似度:60%
Journal of the Brazilian Chemical Society          2003          14          759-763
Indium Mediated Isoprenylation of Carbonyl Compounds with 2-Bromomethyl-1,3-butadiene. A Short Synthesis of (±)-Ipsenol
Marco A. Ceschi, Cesar Petzhold and Rossana A. Schenato
Structure      13C NMR   碳谱模拟图

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30 .     5,7-Dibromo-1,3,3-trimethylindolin-2-one
C11H12Br2NO     相似度:60%
Tetrahedron          2012          68          8330-8339
Synthesis of porphyrin indolin-2-one conjugates via palladium-catalyzed amination reactions
José C.J.M.D.S. Menezes, Ana M.V.M. Pereira, Maria G.P.M.S. Neves, Artur M.S. Silva, Sérgio M. Santos, Sabrina T. Martinez, Bárbara V. Silva, Ângelo C. Pinto, José A.S. Cavaleiro
Structure      13C NMR   碳谱模拟图
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