| SpectraBase Spectrum ID |
IvP8hG1XfOU |
| Name |
L-Proline, N-(cyclohexanecarbonyl)-, hexadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
449.386894503 u |
| Formula |
C28H51NO3 |
| InChI |
InChI=1S/C28H51NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-24-32-28(31)26-22-19-23-29(26)27(30)25-20-16-15-17-21-25/h25-26H,2-24H2,1H3 |
| InChIKey |
LVKYGWBMFAAZMF-UHFFFAOYSA-N |
| Molecular Weight |
449.720 g/mol |
| SMILES |
C1C(CCCC1)C(N1CCCC1C(=O)OCCCCCCCCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921076 |
