| SpectraBase Spectrum ID |
6CDsPAEeOeE |
| Name |
dl-Alanine, N-methyl-N-(byt-3-en-1-yloxycarbonyl)-, dodecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.287908736 u |
| Formula |
C21H39NO4 |
| InChI |
InChI=1S/C21H39NO4/c1-5-7-9-10-11-12-13-14-15-16-18-25-20(23)19(3)22(4)21(24)26-17-8-6-2/h6,19H,2,5,7-18H2,1,3-4H3 |
| InChIKey |
LVRUYSBHTNCPOE-UHFFFAOYSA-N |
| Molecular Weight |
369.546 g/mol |
| SMILES |
CC(N(C)C(=O)OCCC=C)C(=O)OCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917704 |
