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Benzamide, 3-bromo-N-(2-butyl)-N-hexyl-

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

Benzamide, 3-bromo-N-(2-butyl)-N-hexyl-
SpectraBase Compound ID JYEQZGBRdOI
InChI InChI=1S/C17H26BrNO/c1-4-6-7-8-12-19(14(3)5-2)17(20)15-10-9-11-16(18)13-15/h9-11,13-14H,4-8,12H2,1-3H3
InChIKey MKKIQWYEVKGTPN-UHFFFAOYSA-N
Mol Weight 340.31 g/mol
Molecular Formula C17H26BrNO
Exact Mass 339.119777 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1XmPCmx0Xam
Name Benzamide, 3-bromo-N-(2-butyl)-N-hexyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 339.119777460 u
Formula C17H26BrNO
InChI InChI=1S/C17H26BrNO/c1-4-6-7-8-12-19(14(3)5-2)17(20)15-10-9-11-16(18)13-15/h9-11,13-14H,4-8,12H2,1-3H3
InChIKey MKKIQWYEVKGTPN-UHFFFAOYSA-N
Molecular Weight 340.305 g/mol
SMILES C1=CC=C(C=C1C(N(CCCCCC)C(CC)C)=O)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.958848