| SpectraBase Compound ID | 5SD5Spr8pGk |
|---|---|
| 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 |
| Mol Weight | 247.25 g/mol |
| Molecular Formula | C10H17NO6 |
| Exact Mass | 247.105587 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Irm0DoGKpWc |
|---|---|
| Name | N-Methyl-N-ethoxycarbonyl-D-aspartic acid, dimethyl ester |
| Comments | Computed using HOSE algorithm |
| 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 |