SpectraBase Spectrum ID |
DjF09jp3eXT |
Name |
L-Alanine, N-(2-methoxyethoxycarbonyl)-, propyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
233.126322711 u |
Formula |
C10H19NO5 |
InChI |
InChI=1S/C10H19NO5/c1-4-5-15-9(12)8(2)11-10(13)16-7-6-14-3/h8H,4-7H2,1-3H3,(H,11,13) |
InChIKey |
NBKSWWXIYXZPJE-UHFFFAOYSA-N |
Molecular Weight |
233.264 g/mol |
SMILES |
COCCOC(NC(C(OCCC)=O)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.885485 |