SpectraBase Spectrum ID |
7LJqFmxYFF5 |
Name |
Benzamide, N-(2-butyl)-N-octadecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
429.397065265 u |
Formula |
C29H51NO |
InChI |
InChI=1S/C29H51NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26-30(27(3)5-2)29(31)28-24-21-20-22-25-28/h20-22,24-25,27H,4-19,23,26H2,1-3H3 |
InChIKey |
WWARKXKYRMULBY-UHFFFAOYSA-N |
Molecular Weight |
429.733 g/mol |
SMILES |
C(N(CCCCCCCCCCCCCCCCCC)C(CC)C)(=O)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.832535 |