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(2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(2,5-dimethoxyphenyl)-2-propenamide

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(2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(2,5-dimethoxyphenyl)-2-propenamide
SpectraBase Compound ID 9tSl1nWUBe
InChI InChI=1S/C19H14ClF3N2O3/c1-27-14-4-6-17(28-2)11(8-14)7-12(10-24)18(26)25-16-9-13(19(21,22)23)3-5-15(16)20/h3-9H,1-2H3,(H,25,26)/b12-7+
InChIKey YGRFSQQPHIIVHV-KPKJPENVSA-N
Mol Weight 410.78 g/mol
Molecular Formula C19H14ClF3N2O3
Exact Mass 410.064505 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ACsHCZk9Hjo
Name (2E)-N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(2,5-dimethoxyphenyl)-2-propenamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.064504505 u
Formula C19H14ClF3N2O3
InChI InChI=1S/C19H14ClF3N2O3/c1-27-14-4-6-17(28-2)11(8-14)7-12(10-24)18(26)25-16-9-13(19(21,22)23)3-5-15(16)20/h3-9H,1-2H3,(H,25,26)/b12-7+
InChIKey YGRFSQQPHIIVHV-KPKJPENVSA-N
Molecular Weight 410.780 g/mol
SMILES N(C(\C(=C\C1=C(C=CC(=C1)OC)OC)C#N)=O)C=1C=C(C(F)(F)F)C=CC1Cl