SpectraBase Spectrum ID |
BmhdS350Y7s |
Name |
Benzamide, 4-butyl-N-allyl-N-(3-methylbutyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
287.224914557 u |
Formula |
C19H29NO |
InChI |
InChI=1S/C19H29NO/c1-5-7-8-17-9-11-18(12-10-17)19(21)20(14-6-2)15-13-16(3)4/h6,9-12,16H,2,5,7-8,13-15H2,1,3-4H3 |
InChIKey |
AYPCXABYWLLTTH-UHFFFAOYSA-N |
SMILES |
C(N(CCC(C)C)CC=C)(=O)C=1C=CC(=CC1)CCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893988 |