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Benzamide, 2-bromo-N-benzyl-N-octyl-

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

Benzamide, 2-bromo-N-benzyl-N-octyl-
SpectraBase Compound ID LvksfZSfxgn
InChI InChI=1S/C22H28BrNO/c1-2-3-4-5-6-12-17-24(18-19-13-8-7-9-14-19)22(25)20-15-10-11-16-21(20)23/h7-11,13-16H,2-6,12,17-18H2,1H3
InChIKey USOXCCYSRLVQMP-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

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SpectraBase Spectrum ID H9L4StQbKUU
Name Benzamide, 2-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/c1-2-3-4-5-6-12-17-24(18-19-13-8-7-9-14-19)22(25)20-15-10-11-16-21(20)23/h7-11,13-16H,2-6,12,17-18H2,1H3
InChIKey USOXCCYSRLVQMP-UHFFFAOYSA-N
Molecular Weight 402.376 g/mol
SMILES C(N(CCCCCCCC)CC1=CC=CC=C1)(=O)C=1C(Br)=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.915064