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二妞

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[求助] 微谱求助，谢谢啦 已有2人参与

溶剂：DMSO
22.6,33.8,37.3,55.3,74.1,96.6,106.4,123.6,124.9,142.9,160.2,168.9,179.5
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1楼 2014-08-25 14:13:15
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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
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10个化合物(查询结果仅供参考)
1 .     9-Chloro-5a,7-dimethyl-4,5,5a,6-tetrahydro-[1,2]diazepino[7,1-b]quinazoline-2,11(1H,3H)-dione
C14H16ClN3O2     相似度:57.1%
European Journal of Organic Chemistry          2012                   1790-1799
New Linearly and Angularly Fused Quinazolinones: Synthesis through Gold(I)-Catalyzed Cascade Reactions and Anticancer Activities
Nitin T. Patil, Pediredla G. V. V. Lakshmi, Balasubramanian Sridhar, Sujata Patra, Manika Pal Bhadra and Chitta Ranjan Patra
Structure      13C NMR   碳谱模拟图
2 .     (R)-1-(3,5-Dimethoxyphenyl)-2-methylheptane
C16H26O2     相似度:53.8%
Bioorganic & Medicinal Chemistry          1998          6          2383-2396
Synthesis and pharmacology of the isomeric methylheptyl-Δ8-tetrahydrocannabinols
John W. Huffman, John Liddle, Sammy G. Duncan Jr., Shu Yu, Billy R. Martin, Jenny L. Wiley
Structure      13C NMR   碳谱模拟图
3 .     (R)-1-(3,5-Dimethoxyphenyl)-3-methylheptane
C16H26O2     相似度:53.8%
Bioorganic & Medicinal Chemistry          1998          6          2383-2396
Synthesis and pharmacology of the isomeric methylheptyl-Δ8-tetrahydrocannabinols
John W. Huffman, John Liddle, Sammy G. Duncan Jr., Shu Yu, Billy R. Martin, Jenny L. Wiley
Structure      13C NMR   碳谱模拟图
4 .     2-{2-[(4-methoxyphenyl)thio]ethyl}-1H-isoindole-1,3(2H)-dione
    相似度:53.8%
Bioorganic & Medicinal Chemistry          2010          18          6496-6511
Design, synthesis, and pharmacological effects of structurally simple ligands for MT1 and MT2 melatonin receptors
Alessia Carocci, Alessia Catalano, Angelo Lovece, Giovanni Lentini, Andrea Duranti, Valeria Lucini, Marilou Pannacci, Francesco Scaglione, Carlo Franchini
Structure      13C NMR   碳谱模拟图
5 .     N-(2,3,4-trimethoxylbenzyl)acetamide
C12H17NO4     相似度:53.8%
Tetrahedron          2012          68          2342-2348
One-pot stibine modified Co2(CO)8 catalyzed reductive N-alkylation of primary amides with carbonyl compounds
Laura Rubio-Pérez, Pankaj Sharma, F. Javier Pérez-Flores, Luis Velasco, J. Luis. Arias, Armando Cabrera
Structure      13C NMR   碳谱模拟图
6 .     compound 22
C13H21NO3     相似度:53.8%
Heterocycles          2012          84          1141-1170
Convergent Total Syntheses of the Pentacyclic Lamellarins K, T, U and W via the Addition of Azomethine Ylides to Tethered Tolans
Bernard L. Flynn and Martin G. Banwell
Structure      13C NMR   碳谱模拟图
7 .     N-{[5-(4-tert-butylphenyl)furan-2-yl]methyl}acetamide
C17H21NO2     相似度:53.8%
European Journal of Organic Chemistry          2010                   4412-4425
Palladium-Catalysed Direct 5-Arylation of Furfurylamine or 2-(Aminoalkyl)thiophene Derivatives
Julien Roger and Henri Doucet
Structure      13C NMR   碳谱模拟图
8 .     6-Methyl-5-(10-oxymethylene-isobutylene)-lactone
C9H14O3     相似度:53.8%
Natural Products and Bioprospecting          2012          2          200-205
Twelve new compounds from the basidiomycete Boreostereum vibrans
Jian-Hai DING, Tao FENG, Zheng-Hui LI, Liang LI, and Ji-Kai LIU
Structure      13C NMR   碳谱模拟图
9 .     3-O-methylquercetin
    相似度:50%
Journal of Natural Products          1989          Vol 52          629
Isolation of Flavonoids and a Chalcone from Helichrysum odoratissimum and Synthesis of Helichrysetin
Luc Van Puyvelde, Norbert De Kimpe, Jean Costa, Viateur Munyjabo, Speciosa Nyirankuliza, Etienne Hakizamungu, Niceas Schamp
Structure      13C NMR   碳谱模拟图
10 .     compound 2c
    相似度:50%
Canadian Journal of Chemistry          2007          85          42-46
Copper-mediated N-arylation of electron-deficient pyrroles and indoles
Henri Bekolo
Structure      13C NMR   碳谱模拟图
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Domyallbesttohaveahappylife.
2楼2014-08-25 14:31:36
已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖

lifeliuyan

至尊木虫 (职业作家)

【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与，应助指数 +1
二妞: 金币+15, ★★★很有帮助 2014-08-27 14:40:24
查询结果：共查到10个化合物(查询结果仅供参考)
1 .     9-Chloro-5a,7-dimethyl-4,5,5a,6-tetrahydro-[1,2]diazepino[7,1-b]quinazoline-2,11(1H,3H)-dione
C14H16ClN3O2     相似度:57.1%
European Journal of Organic Chemistry          2012                   1790-1799
New Linearly and Angularly Fused Quinazolinones: Synthesis through Gold(I)-Catalyzed Cascade Reactions and Anticancer Activities
Nitin T. Patil, Pediredla G. V. V. Lakshmi, Balasubramanian Sridhar, Sujata Patra, Manika Pal Bhadra and Chitta Ranjan Patra
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
2 .     (R)-1-(3,5-Dimethoxyphenyl)-2-methylheptane
C16H26O2     相似度:53.8%
Bioorganic & Medicinal Chemistry          1998          6          2383-2396
Synthesis and pharmacology of the isomeric methylheptyl-Δ8-tetrahydrocannabinols
John W. Huffman, John Liddle, Sammy G. Duncan Jr., Shu Yu, Billy R. Martin, Jenny L. Wiley
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
3 .     (R)-1-(3,5-Dimethoxyphenyl)-3-methylheptane
C16H26O2     相似度:53.8%
Bioorganic & Medicinal Chemistry          1998          6          2383-2396
Synthesis and pharmacology of the isomeric methylheptyl-Δ8-tetrahydrocannabinols
John W. Huffman, John Liddle, Sammy G. Duncan Jr., Shu Yu, Billy R. Martin, Jenny L. Wiley
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
4 .     2-{2-[(4-methoxyphenyl)thio]ethyl}-1H-isoindole-1,3(2H)-dione
    相似度:53.8%
Bioorganic & Medicinal Chemistry          2010          18          6496-6511
Design, synthesis, and pharmacological effects of structurally simple ligands for MT1 and MT2 melatonin receptors
Alessia Carocci, Alessia Catalano, Angelo Lovece, Giovanni Lentini, Andrea Duranti, Valeria Lucini, Marilou Pannacci, Francesco Scaglione, Carlo Franchini
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
5 .     N-(2,3,4-trimethoxylbenzyl)acetamide
C12H17NO4     相似度:53.8%
Tetrahedron          2012          68          2342-2348
One-pot stibine modified Co2(CO)8 catalyzed reductive N-alkylation of primary amides with carbonyl compounds
Laura Rubio-Pérez, Pankaj Sharma, F. Javier Pérez-Flores, Luis Velasco, J. Luis. Arias, Armando Cabrera
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
6 .     compound 22
C13H21NO3     相似度:53.8%
Heterocycles          2012          84          1141-1170
Convergent Total Syntheses of the Pentacyclic Lamellarins K, T, U and W via the Addition of Azomethine Ylides to Tethered Tolans
Bernard L. Flynn and Martin G. Banwell
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
7 .     N-{[5-(4-tert-butylphenyl)furan-2-yl]methyl}acetamide
C17H21NO2     相似度:53.8%
European Journal of Organic Chemistry          2010                   4412-4425
Palladium-Catalysed Direct 5-Arylation of Furfurylamine or 2-(Aminoalkyl)thiophene Derivatives
Julien Roger and Henri Doucet
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
8 .     6-Methyl-5-(10-oxymethylene-isobutylene)-lactone
C9H14O3     相似度:53.8%
Natural Products and Bioprospecting          2012          2          200-205
Twelve new compounds from the basidiomycete Boreostereum vibrans
Jian-Hai DING, Tao FENG, Zheng-Hui LI, Liang LI, and Ji-Kai LIU
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
9 .     3-O-methylquercetin
    相似度:50%
Journal of Natural Products          1989          Vol 52          629
Isolation of Flavonoids and a Chalcone from Helichrysum odoratissimum and Synthesis of Helichrysetin
Luc Van Puyvelde, Norbert De Kimpe, Jean Costa, Viateur Munyjabo, Speciosa Nyirankuliza, Etienne Hakizamungu, Niceas Schamp
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
10 .     compound 2c
    相似度:50%
Canadian Journal of Chemistry          2007          85          42-46
Copper-mediated N-arylation of electron-deficient pyrroles and indoles
Henri Bekolo
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
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3楼2014-08-25 14:50:09
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