| SpectraBase Spectrum ID |
7wA6ODVlEx |
| Name |
L-Proline, N-(cyclohexanecarbonyl)-, pentadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
435.371244439 u |
| Formula |
C27H49NO3 |
| InChI |
InChI=1S/C27H49NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-23-31-27(30)25-21-18-22-28(25)26(29)24-19-15-14-16-20-24/h24-25H,2-23H2,1H3 |
| InChIKey |
JNNVIUDRQGOFMZ-UHFFFAOYSA-N |
| Molecular Weight |
435.693 g/mol |
| SMILES |
C1(CCCCC1)C(N1CCCC1C(=O)OCCCCCCCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917139 |
