| SpectraBase Spectrum ID |
2SLOqsMIMoW |
| Name |
L-Leucine, N-allyloxycarbonyl-N-methyl-, pentadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
439.366159058 u |
| Formula |
C26H49NO4 |
| InChI |
InChI=1S/C26H49NO4/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-21-30-25(28)24(22-23(3)4)27(5)26(29)31-20-7-2/h7,23-24H,2,6,8-22H2,1,3-5H3 |
| InChIKey |
XOEJOXISVWTHCE-UHFFFAOYSA-N |
| Molecular Weight |
439.681 g/mol |
| SMILES |
C=CCOC(N(C(C(OCCCCCCCCCCCCCCC)=O)CC(C)C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.851995 |
