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Benzamide, 2-bromo-N-propyl-N-octadecyl-

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

Benzamide, 2-bromo-N-propyl-N-octadecyl-
SpectraBase Compound ID 6NM0SA0SVSf
InChI InChI=1S/C28H48BrNO/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25-30(24-4-2)28(31)26-22-19-20-23-27(26)29/h19-20,22-23H,3-18,21,24-25H2,1-2H3
InChIKey PFIOKTGJCGRCRA-UHFFFAOYSA-N
Mol Weight 494.6 g/mol
Molecular Formula C28H48BrNO
Exact Mass 493.291928 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JaBZDhtFSXM
Name Benzamide, 2-bromo-N-propyl-N-octadecyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 493.291928169 u
Formula C28H48BrNO
InChI InChI=1S/C28H48BrNO/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25-30(24-4-2)28(31)26-22-19-20-23-27(26)29/h19-20,22-23H,3-18,21,24-25H2,1-2H3
InChIKey PFIOKTGJCGRCRA-UHFFFAOYSA-N
Molecular Weight 494.602 g/mol
SMILES C(=O)(N(CCC)CCCCCCCCCCCCCCCCCC)C=1C=CC=CC1Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.812499