| SpectraBase Spectrum ID |
Iv1XwU9miE5 |
| Name |
L-Glutamic acid, N-methyl-N-ethoxycarbonyl-, dimethyl ester (isomer 2) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.121237330 u |
| Formula |
C11H19NO6 |
| InChI |
InChI=1S/C11H19NO6/c1-5-18-11(15)12(2)8(10(14)17-4)6-7-9(13)16-3/h8H,5-7H2,1-4H3 |
| InChIKey |
PKCPMTDZHLNSKD-UHFFFAOYSA-N |
| Molecular Weight |
261.274 g/mol |
| SMILES |
C(OC)(CCC(C(OC)=O)N(C)C(OCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.87274 |
