SpectraBase Spectrum ID |
KAehdpvlWpp |
Name |
Octanamide, N-propyl-N-octadecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
437.459665523 u |
Formula |
C29H59NO |
InChI |
InChI=1S/C29H59NO/c1-4-7-9-11-12-13-14-15-16-17-18-19-20-21-23-25-28-30(27-6-3)29(31)26-24-22-10-8-5-2/h4-28H2,1-3H3 |
InChIKey |
XDNUICHMPDHYHD-UHFFFAOYSA-N |
Molecular Weight |
437.797 g/mol |
SMILES |
C(=O)(N(CCC)CCCCCCCCCCCCCCCCCC)CCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.922411 |