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

*Links on SpectraBase are not permalinks.
benzoic acid, 4-[[[4-(trifluoromethyl)benzoyl]amino]methyl]-
SpectraBase Compound ID DbZeVePLpsA
InChI InChI=1S/C16H12F3NO3/c17-16(18,19)13-7-5-11(6-8-13)14(21)20-9-10-1-3-12(4-2-10)15(22)23/h1-8H,9H2,(H,20,21)(H,22,23)
InChIKey OVTGRKNVGAQYKF-UHFFFAOYSA-N
Mol Weight 323.27 g/mol
Molecular Formula C16H12F3NO3
Exact Mass 323.076928 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID B1ILPNCuGWW
Name 4-({[4-(trifluoromethyl)benzoyl]amino}methyl)benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12F3NO3
InChI InChI=1S/C16H12F3NO3/c17-16(18,19)13-7-5-11(6-8-13)14(21)20-9-10-1-3-12(4-2-10)15(22)23/h1-8H,9H2,(H,20,21)(H,22,23)
InChIKey OVTGRKNVGAQYKF-UHFFFAOYSA-N
Molecular Weight 323.271 g/mol
SMILES N(C(c1ccc(C(F)(F)F)cc1)=O)Cc1ccc(C(=O)O)cc1
SPLASH splash10-00dj-6901000000-9ce2880ca84f8ab6caef
Synonyms 4-[[[4-(trifluoromethyl)phenyl]carbonylamino]methyl]benzoic acid 4-[[[oxo-[4-(trifluoromethyl)phenyl]methyl]amino]methyl]benzoic acid
Wiley ID 1465457