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2-(3,4-dimethylphenyl)-N-[2-(trifluoromethyl)phenyl]-4-quinolinecarboxamide

View entire compound with spectra: 2 NMR

2-(3,4-dimethylphenyl)-N-[2-(trifluoromethyl)phenyl]-4-quinolinecarboxamide
SpectraBase Compound ID BUwPNXeEC7W
InChI InChI=1S/C25H19F3N2O/c1-15-11-12-17(13-16(15)2)23-14-19(18-7-3-5-9-21(18)29-23)24(31)30-22-10-6-4-8-20(22)25(26,27)28/h3-14H,1-2H3,(H,30,31)
InChIKey DMMQPJJBVQQNDO-UHFFFAOYSA-N
Mol Weight 420.44 g/mol
Molecular Formula C25H19F3N2O
Exact Mass 420.144948 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2sn6pHDk1Lt
Name 2-(3,4-Dimethylphenyl)-N-[2-(trifluoromethyl)phenyl]-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 420.144947728 u
Formula C25H19F3N2O
InChI InChI=1S/C25H19F3N2O/c1-15-11-12-17(13-16(15)2)23-14-19(18-7-3-5-9-21(18)29-23)24(31)30-22-10-6-4-8-20(22)25(26,27)28/h3-14H,1-2H3,(H,30,31)
InChIKey DMMQPJJBVQQNDO-UHFFFAOYSA-N
Molecular Weight 420.435 g/mol
SMILES N(C(C=1C=C(C2=CC(C)=C(C=C2)C)N=C2C1C=CC=C2)=O)C=1C(C(F)(F)F)=CC=CC1