SpectraBase Spectrum ID |
5rk7Pq5QfEG |
Name |
Alanine, N-methyl-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 |
247.141972775 u |
Formula |
C11H21NO5 |
InChI |
InChI=1S/C11H21NO5/c1-5-6-16-10(13)9(2)12(3)11(14)17-8-7-15-4/h9H,5-8H2,1-4H3 |
InChIKey |
AZWFSSJIVJUGEO-UHFFFAOYSA-N |
Molecular Weight |
247.291 g/mol |
SMILES |
COCCOC(N(C)C(C)C(OCCC)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.806279 |