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

*Links on SpectraBase are not permalinks.

Benzamide, 3-bromo-N-benzyl-N-octyl-

View entire compound with spectra: 1 NMR, and 1 FTIR

Benzamide, 3-bromo-N-benzyl-N-octyl-
SpectraBase Compound ID 41KRKznsuLt
InChI InChI=1S/C22H28BrNO/c1-2-3-4-5-6-10-16-24(18-19-12-8-7-9-13-19)22(25)20-14-11-15-21(23)17-20/h7-9,11-15,17H,2-6,10,16,18H2,1H3
InChIKey GTMLFRFVLFZWKU-UHFFFAOYSA-N
Mol Weight 402.38 g/mol
Molecular Formula C22H28BrNO
Exact Mass 401.135428 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 B86r2QAlcwI
Name Benzamide, 3-bromo-N-benzyl-N-octyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.135427525 u
Formula C22H28BrNO
InChI InChI=1S/C22H28BrNO/c1-2-3-4-5-6-10-16-24(18-19-12-8-7-9-13-19)22(25)20-14-11-15-21(23)17-20/h7-9,11-15,17H,2-6,10,16,18H2,1H3
InChIKey GTMLFRFVLFZWKU-UHFFFAOYSA-N
Molecular Weight 402.376 g/mol
SMILES C(N(CCCCCCCC)CC1=CC=CC=C1)(=O)C=1C=C(C=CC1)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.853411