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

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Benzamide, 2-bromo-N-(2-butyl)-N-hexyl-
SpectraBase Compound ID 6IEJHDH9wAr
InChI InChI=1S/C17H26BrNO/c1-4-6-7-10-13-19(14(3)5-2)17(20)15-11-8-9-12-16(15)18/h8-9,11-12,14H,4-7,10,13H2,1-3H3
InChIKey UZELZDHGNPDSPE-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 1Z9GcSoimGt
Name Benzamide, 2-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/c1-4-6-7-10-13-19(14(3)5-2)17(20)15-11-8-9-12-16(15)18/h8-9,11-12,14H,4-7,10,13H2,1-3H3
InChIKey UZELZDHGNPDSPE-UHFFFAOYSA-N
Molecular Weight 340.305 g/mol
SMILES C(=O)(N(CCCCCC)C(CC)C)C=1C(Br)=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.903023