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Benzamide, 2-bromo-N-butyl-N-(hept-2-yl)-

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

Benzamide, 2-bromo-N-butyl-N-(hept-2-yl)-
SpectraBase Compound ID Z13pmmZ7Ud
InChI InChI=1S/C18H28BrNO/c1-4-6-8-11-15(3)20(14-7-5-2)18(21)16-12-9-10-13-17(16)19/h9-10,12-13,15H,4-8,11,14H2,1-3H3
InChIKey ZGYLJAWRRAMFQY-UHFFFAOYSA-N
Mol Weight 354.33 g/mol
Molecular Formula C18H28BrNO
Exact Mass 353.135428 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EqYvWyLRdAK
Name Benzamide, 2-bromo-N-butyl-N-(hept-2-yl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.135427525 u
Formula C18H28BrNO
InChI InChI=1S/C18H28BrNO/c1-4-6-8-11-15(3)20(14-7-5-2)18(21)16-12-9-10-13-17(16)19/h9-10,12-13,15H,4-8,11,14H2,1-3H3
InChIKey ZGYLJAWRRAMFQY-UHFFFAOYSA-N
Molecular Weight 354.332 g/mol
SMILES C(=O)(N(CCCC)C(CCCCC)C)C=1C=CC=CC1Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.888597