| SpectraBase Spectrum ID |
JYWKrrmvBf2 |
| Name |
dl-Norleucine, N-(2-methoxyethoxycarbonyl)-, pentadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
443.361073677 u |
| Formula |
C25H49NO5 |
| InChI |
InChI=1S/C25H49NO5/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-20-30-24(27)23(19-7-5-2)26-25(28)31-22-21-29-3/h23H,4-22H2,1-3H3,(H,26,28) |
| InChIKey |
BHJPUWXIHXHXHL-UHFFFAOYSA-N |
| Molecular Weight |
443.669 g/mol |
| SMILES |
C(COC(C(NC(OCCOC)=O)CCCC)=O)CCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.852045 |
