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Benzamide, 4-butyl-N-allyl-N-hexyl-

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

Benzamide, 4-butyl-N-allyl-N-hexyl-
SpectraBase Compound ID KzZTFvLBLv0
InChI InChI=1S/C20H31NO/c1-4-7-9-10-17-21(16-6-3)20(22)19-14-12-18(13-15-19)11-8-5-2/h6,12-15H,3-5,7-11,16-17H2,1-2H3
InChIKey LJZPMSGBGVGISG-UHFFFAOYSA-N
Mol Weight 301.47 g/mol
Molecular Formula C20H31NO
Exact Mass 301.240565 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4T5FIAp1nt2
Name Benzamide, 4-butyl-N-allyl-N-hexyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 301.240564621 u
Formula C20H31NO
InChI InChI=1S/C20H31NO/c1-4-7-9-10-17-21(16-6-3)20(22)19-14-12-18(13-15-19)11-8-5-2/h6,12-15H,3-5,7-11,16-17H2,1-2H3
InChIKey LJZPMSGBGVGISG-UHFFFAOYSA-N
SMILES C(N(CCCCCC)CC=C)(=O)C=1C=CC(=CC1)CCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.967928