| SpectraBase Spectrum ID |
KnJQ6Zqzj6Z |
| Name |
L-Proline, N-(cyclopropylcarbonyl)-, heptadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
421.355594374 u |
| Formula |
C26H47NO3 |
| InChI |
InChI=1S/C26H47NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-22-30-26(29)24-18-17-21-27(24)25(28)23-19-20-23/h23-24H,2-22H2,1H3 |
| InChIKey |
CGGHOKPCQQUPRR-UHFFFAOYSA-N |
| Molecular Weight |
421.666 g/mol |
| SMILES |
CCCCCCCCCCCCCCCCCOC(C1N(CCC1)C(=O)C1CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.880118 |
