| SpectraBase Spectrum ID |
rq9zQcIoBg |
| Name |
L-Norvaline, N-methoxycarbonyl-, heptadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
413.350508993 u |
| Formula |
C24H47NO4 |
| InChI |
InChI=1S/C24H47NO4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-29-23(26)22(20-5-2)25-24(27)28-3/h22H,4-21H2,1-3H3,(H,25,27) |
| InChIKey |
OUVMHNWCZYWKEL-UHFFFAOYSA-N |
| Molecular Weight |
413.643 g/mol |
| SMILES |
COC(NC(C(OCCCCCCCCCCCCCCCCC)=O)CCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913354 |
