| SpectraBase Compound ID | ItfXP3mDNed |
|---|---|
| InChI | InChI=1S/C11H19NO6/c1-7(2)18-11(15)12(3)8(10(14)17-5)6-9(13)16-4/h7-8H,6H2,1-5H3 |
| InChIKey | WFUDVJSLZVYMHD-UHFFFAOYSA-N |
| Mol Weight | 261.27 g/mol |
| Molecular Formula | C11H19NO6 |
| Exact Mass | 261.121237 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 68XWqSKEkl1 |
|---|---|
| Name | N-Methyl-N-(isopropyloxycarbonyl)-D-aspartic acid, dimethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.121237330 u |
| Formula | C11H19NO6 |
| InChI | InChI=1S/C11H19NO6/c1-7(2)18-11(15)12(3)8(10(14)17-5)6-9(13)16-4/h7-8H,6H2,1-5H3 |
| InChIKey | WFUDVJSLZVYMHD-UHFFFAOYSA-N |
| Molecular Weight | 261.274 g/mol |
| SMILES | C(OC)(CC(N(C)C(OC(C)C)=O)C(OC)=O)=O |