SpectraBase Spectrum ID |
5k0rtlylNSM |
Name |
Benzamide, 4-methyl-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 |
443.412715330 u |
Formula |
C30H53NO |
InChI |
InChI=1S/C30H53NO/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-31(28(4)6-2)30(32)29-24-22-27(3)23-25-29/h22-25,28H,5-21,26H2,1-4H3 |
InChIKey |
XYLOCIWGPLVOPF-UHFFFAOYSA-N |
Molecular Weight |
443.760 g/mol |
SMILES |
C(N(CCCCCCCCCCCCCCCCCC)C(CC)C)(=O)C=1C=CC(=CC1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.839651 |