![Propanoic acid, 3-[(2-ethoxy-2-oxoethyl)amino]-3-oxo-, ethyl ester](/api/spectrum/IIwlgFDCzpZ/structure.png?h=300&w=458 "Propanoic acid, 3-[(2-ethoxy-2-oxoethyl)amino]-3-oxo-, ethyl ester")
| SpectraBase Compound ID | BnM9pDt9oAh |
|---|---|
| InChI | InChI=1S/C9H15NO5/c1-3-14-8(12)5-7(11)10-6-9(13)15-4-2/h3-6H2,1-2H3,(H,10,11) |
| InChIKey | DFQQYYNSQWWZNH-UHFFFAOYSA-N |
| Mol Weight | 217.22 g/mol |
| Molecular Formula | C9H15NO5 |
| Exact Mass | 217.095023 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IIwlgFDCzpZ |
|---|---|
| Name | Propanoic acid, 3-[(2-ethoxy-2-oxoethyl)amino]-3-oxo-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.095022582 u |
| Formula | C9H15NO5 |
| InChI | InChI=1S/C9H15NO5/c1-3-14-8(12)5-7(11)10-6-9(13)15-4-2/h3-6H2,1-2H3,(H,10,11) |
| InChIKey | DFQQYYNSQWWZNH-UHFFFAOYSA-N |
| Molecular Weight | 217.221 g/mol |
| SMILES | C(=O)(CNC(CC(OCC)=O)=O)OCC |