| SpectraBase Spectrum ID |
GYCiPilKgSZ |
| Name |
L-Proline, N-valeryl-, heptadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
437.386894503 u |
| Formula |
C27H51NO3 |
| InChI |
InChI=1S/C27H51NO3/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-24-31-27(30)25-21-20-23-28(25)26(29)22-6-4-2/h25H,3-24H2,1-2H3 |
| InChIKey |
ZHUPJDHUUOIDQA-UHFFFAOYSA-N |
| Molecular Weight |
437.709 g/mol |
| SMILES |
C(N1CCCC1C(=O)OCCCCCCCCCCCCCCCCC)(=O)CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945698 |
