| SpectraBase Spectrum ID |
7dwx7tPFPtC |
| Name |
N-Methyl-N-ethoxycarbonyl-D-aspartic acid, dimethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
247.105587265 u |
| Formula |
C10H17NO6 |
| InChI |
InChI=1S/C10H17NO6/c1-5-17-10(14)11(2)7(9(13)16-4)6-8(12)15-3/h7H,5-6H2,1-4H3 |
| InChIKey |
RCCMEDSLDVMIHM-UHFFFAOYSA-N |
| Molecular Weight |
247.247 g/mol |
| SMILES |
C(OC)(CC(N(C)C(OCC)=O)C(OC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951706 |
