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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
116.954,117.746,127.645,127.837,129.088,129.131,129.884,130.37,130.917,130.963,132.038,134.448,134.635,153.359,153.747,213.929
  
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3927个化合物(查询结果仅供参考)  
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1 .     (E)-3-(2-chlorophenyl)-3-[3-(2-chlorophenyl)-1H-1-pyrazolyl]-2-propenal
    相似度:76.4%
Journal of Heterocyclic Chemistry          2011          48          671-677
Ring and side chain formylated pyrazoles from acetophenone azines and Vilsmeier's reagent
Ramaiyan Manikannan and Shanmugam Muthusubramanian
Structure      13C NMR   碳谱模拟图

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2 .     compound 5e
    相似度:75%
Journal of Heterocyclic Chemistry          2003          40          885-893
Reactions of isocyanates with methyl N-(cyanothioformyl)anthranilate
L. M. Deck,E. P. Papadopoulos and K. A. Smith
Structure      13C NMR   碳谱模拟图

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3 .     2-(p-chlorophenyl)-6-cyano-3-phenylbenzofuran
C21H12ONCl     相似度:75%
Heterocycles          2012          86          1103-1118
RHODIUM-CATALYZED SYNTHESIS OF BENZOFURANS BY THE REACTION OF KETONES AND o-DIFLUOROBENZENES
Mieko Arisawa,* Soichiro Nakane, Manabu Kuwajima, and Masahiko Yamaguchi
Structure      13C NMR   碳谱模拟图

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4 .     compound 8
C40H24O2Br2     相似度:72.2%
Canadian Journal of Chemistry          2006          84          1487-1503
An examination of VANOL, VAPOL, and VAPOL derivatives as ligands for asymmetric catalytic Diels-Alder reactions1
Douglas P. Heller, Daniel R. Goldberg, Hongqiao Wu, and William D. Wulff
Structure      13C NMR   碳谱模拟图

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5 .     compound 5h
C27H20Cl2NO3PS     相似度:72.2%
Journal of Heterocyclic Chemistry          2008          45          103-107


Structure      13C NMR   碳谱模拟图

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6 .     7-amino-5-(2,4-dichlorophenyl)-1,3-dioxo-2-phenyl-1,2,3-dihydropyrazolo[1,2-a][1,2,4]triazole-6-carbonitrile
C18H11Cl2N5O     相似度:72.2%
Heterocycles          2010          81          2063-2073
Ultrasonic-Assisted One-Pot Synthesis of Pyrazolo[1,2-a][1,2,4]triazole-1,3-diones
Davood Azarifar and Razieh Nejat Yami
Structure      13C NMR   碳谱模拟图

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7 .     3-{[(4-Fluorophenyl)methylene]amino}-2-phenylquinazolin-4(3H)-one
C21H14N3OF     相似度:70.5%
Molecules          2007          12          2413-2426
Antibacterial Activity of Some 3-(Arylideneamino)-2-phenylquinazoline-4(3H)-ones: Synthesis and Preliminary QSAR Studies
Ashis K. Nanda, Subarna Ganguli and Ranadhir Chakraborty
Structure      13C NMR   碳谱模拟图

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8 .     compound 6g
C22H16N4     相似度:70.5%
Archiv der Pharmazie          2002          335          7-14
Synthesis of Imidazo[2,1-a]phthalazines,Potential Inhibitors of p38 MAP Kinase. Prediction of Binding Affinities of Protein Ligands
Sylvie Mavel, Isabelle Thery and Alain Gueiffier
Structure      13C NMR   碳谱模拟图

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9 .     (S)-6-Bromo-2,2'-dihydroxy-1,1'-binaphthyl
    相似度:70%
Tetrahedron          2012          68          464-480
Synthesis of modified binol-phosphoramidites
Carl Recsei, Christopher S.P. McErlean
Structure      13C NMR   碳谱模拟图

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10 .     2-methyl-3-phenylquinazoline-4(3H)-thione
C15H10Cl2N2S     相似度:68.7%
Molecules          2003          8          756-769
Synthesis and Biological Evaluation of Quinazoline-4-thiones
Lenka Kubicová, Martin Šustr, Katarína Kráľová, Vladimír Chobot, Jitka Vytlačilová, Luděk Jahodář, Pia Vuorela, Miloš Macháček and Jarmila Kaustová
Structure      13C NMR   碳谱模拟图

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11 .     compound 7
    相似度:68.7%
Organic letters          2001          3          2129-2131
Synthesis and Crystal Structure of a Tubular Sexithiophene
Michael J. Marsella, Kunsang Yoon, and Fook S. Tham
Structure      13C NMR   碳谱模拟图

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12 .     9-benzyl-8-bromo-6-phenyl-purine
C18H13BrN4     相似度:68.7%
Journal of Heterocyclic Chemistry          2005          42          1369-1379
New calcineurin inhibiting 3-dimethylaminopropyl substituted diarylheterocycles by sonogashira reactions and catalytic hydrogenation
Lunxiang Yin,Jürgen Liebscher and Frank Erdmann
Structure      13C NMR   碳谱模拟图

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13 .     3-phenyl-1H-naphth[1,2-e][1,3]oxazine
C18H13NO     相似度:68.7%
Journal of Heterocyclic Chemistry          2004          41          367-373
Transformation reactions of the betti base analog aminonaphthols
István Szatmári,Anasztázia Hetényi,László Lázár and Ferenc Fülöp
Structure      13C NMR   碳谱模拟图

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14 .     compound 4a
    相似度:68.7%
Journal of Heterocyclic Chemistry          2003          40          885-893
Reactions of isocyanates with methyl N-(cyanothioformyl)anthranilate
L. M. Deck,E. P. Papadopoulos and K. A. Smith
Structure      13C NMR   碳谱模拟图

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15 .     compound 4c
    相似度:68.7%
Journal of Heterocyclic Chemistry          2003          40          885-893
Reactions of isocyanates with methyl N-(cyanothioformyl)anthranilate
L. M. Deck,E. P. Papadopoulos and K. A. Smith
Structure      13C NMR   碳谱模拟图

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16 .     compound 4e
    相似度:68.7%
Journal of Heterocyclic Chemistry          2003          40          885-893
Reactions of isocyanates with methyl N-(cyanothioformyl)anthranilate
L. M. Deck,E. P. Papadopoulos and K. A. Smith
Structure      13C NMR   碳谱模拟图

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17 .     compound 5a
    相似度:68.7%
Journal of Heterocyclic Chemistry          2003          40          885-893
Reactions of isocyanates with methyl N-(cyanothioformyl)anthranilate
L. M. Deck,E. P. Papadopoulos and K. A. Smith
Structure      13C NMR   碳谱模拟图

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18 .     compound 3b
C21H15N5O2     相似度:68.7%
Heterocycles          2009          78          2509-2522
Tetrazolium N-Aminides: Complementary Studies on Synthesis and Properties
Dietrich Moderhack and Matthias Noreiks
Structure      13C NMR   碳谱模拟图

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19 .     Compound 7
C16H11N3O     相似度:68.7%
Bioorganic & Medicinal Chemistry Letters          2003          13          653-656
Protective effect of imidazolopyrazinone antioxidants on ischemia/reperfusion injury
Axelle Arrault, Marlène Dubuisson, Sonia Gharbi, Cécile Marchand, Tony Verbeuren, Alain Rupin, Alex Cordi, Eliete Bouskela, Jean-François Rees, Jacqueline Marchand-Brynaert
Structure      13C NMR   碳谱模拟图

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20 .     2-(ethynylphenyl)-1-(2-naphthyl)-4-phenyl-1-buten-3-yne
    相似度:68.7%
Tetrahedron Letters          2001          42          4099-4102
Photocyclization of a conjugated triaryl ‘Y-enyne’
Bilal R Kaafarani, Douglas C Neckers
Structure      13C NMR   碳谱模拟图

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21 .     (S,S)-1,2,5-Triphenylphospholanium tetrafluoroborate salt
C22H22P     相似度:68.7%
Tetrahedron Letters          2004          45          8153-8156
Chiral 1,2,5-triphenylphospholanium tetrafluoroborate as ligand precursor in Rh-catalyzed asymmetric hydrogenation of methyl (Z)-2-acetamidocinnamate
Cristian Dobrota, Martial Toffano, Jean-Claude Fiaud
Structure      13C NMR   碳谱模拟图

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22 .     8-Hydroxy-indanyl[c]imidazolo[1,2-a]-azepine-7-carbonitrile
C16H9N3O     相似度:68.7%
Zeitschrift für Naturforschung B          2005          60          106-112
Base Catalyzed Synthesis of Novel Fused-Imidazoles from N-Vinyl-1H-imidazole
A. A. Aly
Structure      13C NMR   碳谱模拟图

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23 .     6-Bromo-2,3-diphenylquinoxaline
    相似度:68.7%
Molecules          2012          17          5164-5176
Microwave-assisted Solvent-free Synthesis and in Vitro Antibacterial Screening of Quinoxalines，