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Benzamide, 3-bromo-N-propyl-N-(2-ethylhexyl)-

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

Benzamide, 3-bromo-N-propyl-N-(2-ethylhexyl)-
SpectraBase Compound ID KHlnTBb3Cun
InChI InChI=1S/C18H28BrNO/c1-4-7-9-15(6-3)14-20(12-5-2)18(21)16-10-8-11-17(19)13-16/h8,10-11,13,15H,4-7,9,12,14H2,1-3H3
InChIKey DGFQYUVAPKEIOY-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 C7ocsDzI3m3
Name Benzamide, 3-bromo-N-propyl-N-(2-ethylhexyl)-
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/c1-4-7-9-15(6-3)14-20(12-5-2)18(21)16-10-8-11-17(19)13-16/h8,10-11,13,15H,4-7,9,12,14H2,1-3H3
InChIKey DGFQYUVAPKEIOY-UHFFFAOYSA-N
Molecular Weight 354.332 g/mol
SMILES C1=C(C=C(C=C1)C(N(CC(CCCC)CC)CCC)=O)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.934198