| SpectraBase Spectrum ID |
HW63v0LdyqG |
| Name |
Carbonic acid, monoamide, N-propyl-N-octadecyl-, hexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
439.438930077 u |
| Formula |
C28H57NO2 |
| InChI |
InChI=1S/C28H57NO2/c1-4-7-9-11-12-13-14-15-16-17-18-19-20-21-22-23-26-29(25-6-3)28(30)31-27-24-10-8-5-2/h4-27H2,1-3H3 |
| InChIKey |
KLOSRNNOXUAKMK-UHFFFAOYSA-N |
| Molecular Weight |
439.769 g/mol |
| SMILES |
C(=O)(OCCCCCC)N(CCC)CCCCCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936239 |
