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Benzamide, 2-bromo-N-methyl-N-heptyl-

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

Benzamide, 2-bromo-N-methyl-N-heptyl-
SpectraBase Compound ID HpCvVj3L2TN
InChI InChI=1S/C15H22BrNO/c1-3-4-5-6-9-12-17(2)15(18)13-10-7-8-11-14(13)16/h7-8,10-11H,3-6,9,12H2,1-2H3
InChIKey PUDJNHINSWJZPZ-UHFFFAOYSA-N
Mol Weight 312.25 g/mol
Molecular Formula C15H22BrNO
Exact Mass 311.088477 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3iCaYRS5fXw
Name Benzamide, 2-bromo-N-methyl-N-heptyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.088477331 u
Formula C15H22BrNO
InChI InChI=1S/C15H22BrNO/c1-3-4-5-6-9-12-17(2)15(18)13-10-7-8-11-14(13)16/h7-8,10-11H,3-6,9,12H2,1-2H3
InChIKey PUDJNHINSWJZPZ-UHFFFAOYSA-N
Molecular Weight 312.251 g/mol
SMILES C(=O)(N(CCCCCCC)C)C=1C=CC=CC1Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.872857