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

*Links on SpectraBase are not permalinks.

Benzoic acid, 4-(4-chlorobenzoylamino)-, methyl ester

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

Benzoic acid, 4-(4-chlorobenzoylamino)-, methyl ester
SpectraBase Compound ID 9EYehkuPof4
InChI InChI=1S/C15H12ClNO3/c1-20-15(19)11-4-8-13(9-5-11)17-14(18)10-2-6-12(16)7-3-10/h2-9H,1H3,(H,17,18)
InChIKey JRWKHKQDVYXZJG-UHFFFAOYSA-N
Mol Weight 289.72 g/mol
Molecular Formula C15H12ClNO3
Exact Mass 289.050571 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID JgOuLhnWeWe
Name Benzoic acid, 4-(4-chlorobenzoylamino)-, methyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.050570947 u
Formula C15H12ClNO3
InChI InChI=1S/C15H12ClNO3/c1-20-15(19)11-4-8-13(9-5-11)17-14(18)10-2-6-12(16)7-3-10/h2-9H,1H3,(H,17,18)
InChIKey JRWKHKQDVYXZJG-UHFFFAOYSA-N
SMILES C(NC1=CC=C(C(OC)=O)C=C1)(C1=CC=C(C=C1)Cl)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951448