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(2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-propenamide

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(2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-propenamide
SpectraBase Compound ID BCo3bqw0q4w
InChI InChI=1S/C20H14ClF3N4O2/c1-27-16-6-3-11(8-17(16)28(2)19(27)30)7-12(10-25)18(29)26-15-9-13(20(22,23)24)4-5-14(15)21/h3-9H,1-2H3,(H,26,29)/b12-7+
InChIKey PVJGWWLUVBHJGS-KPKJPENVSA-N
Mol Weight 434.81 g/mol
Molecular Formula C20H14ClF3N4O2
Exact Mass 434.075738 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IkpLXY5uDsX
Name (2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-propenamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H14ClF3N4O2/c1-27-16-6-3-11(8-17(16)28(2)19(27)30)7-12(10-25)18(29)26-15-9-13(20(22,23)24)4-5-14(15)21/h3-9H,1-2H3,(H,26,29)/b12-7+
InChIKey PVJGWWLUVBHJGS-KPKJPENVSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6606
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 62988; UBI_ID: UBI-006608
Synonyms N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-propenamide
Temperature 318 °C