| SpectraBase Compound ID | DEXFYGD4oXT |
|---|---|
| InChI | InChI=1S/C8H13NO4/c1-13-8(12)6-4-7(11)9(5-6)2-3-10/h6,10H,2-5H2,1H3 |
| InChIKey | WOMNOMAETAVDMH-UHFFFAOYSA-N |
| Mol Weight | 187.19 g/mol |
| Molecular Formula | C8H13NO4 |
| Exact Mass | 187.084458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3rXGx6nAx1W |
|---|---|
| Name | 1-(2-Hydroxyethyl)-5-keto-pyrrolidine-3-carboxylic acid methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 187.084457899 u |
| Formula | C8H13NO4 |
| InChI | InChI=1S/C8H13NO4/c1-13-8(12)6-4-7(11)9(5-6)2-3-10/h6,10H,2-5H2,1H3 |
| InChIKey | WOMNOMAETAVDMH-UHFFFAOYSA-N |
| Molecular Weight | 187.195 g/mol |
| SMILES | C1N(C(CC1C(=O)OC)=O)CCO |