For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-Methyl-N-[2-phenyl-1-[[[3-(trifluoroacetyl)phenyl]aminocarbonyl]ethyl]benzamide
SpectraBase Compound ID m4TMj0u8aJ
InChI InChI=1S/C25H21F3N2O3/c1-16-10-12-18(13-11-16)23(32)30-21(14-17-6-3-2-4-7-17)24(33)29-20-9-5-8-19(15-20)22(31)25(26,27)28/h2-13,15,21H,14H2,1H3,(H,29,33)(H,30,32)
InChIKey DKIPFQAOSVVYEJ-UHFFFAOYSA-N
Mol Weight 454.45 g/mol
Molecular Formula C25H21F3N2O3
Exact Mass 454.150427 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AH8MMIvBIo9
Name 4-Methyl-N-[2-phenyl-1-[[[3-(trifluoroacetyl)phenyl]aminocarbonyl]ethyl]benzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 454.150427030 u
Formula C25H21F3N2O3
InChI InChI=1S/C25H21F3N2O3/c1-16-10-12-18(13-11-16)23(32)30-21(14-17-6-3-2-4-7-17)24(33)29-20-9-5-8-19(15-20)22(31)25(26,27)28/h2-13,15,21H,14H2,1H3,(H,29,33)(H,30,32)
InChIKey DKIPFQAOSVVYEJ-UHFFFAOYSA-N
Molecular Weight 454.449 g/mol
SMILES C1=C(C=CC(=C1)C(NC(CC1=CC=CC=C1)C(NC1=CC=CC(C(C(F)(F)F)=O)=C1)=O)=O)C