| SpectraBase Spectrum ID |
7cyc0oQfMbn |
| Name |
L-Proline, N-neopentyloxycarbonyl-, octadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
481.413109251 u |
| Formula |
C29H55NO4 |
| InChI |
InChI=1S/C29H55NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-33-27(31)26-22-21-23-30(26)28(32)34-25-29(2,3)4/h26H,5-25H2,1-4H3 |
| InChIKey |
MCICDFMHTHQJDG-UHFFFAOYSA-N |
| Molecular Weight |
481.762 g/mol |
| SMILES |
C1CCC(N1C(=O)OCC(C)(C)C)C(=O)OCCCCCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.895338 |
