| SpectraBase Compound ID | 3imj6Ugsind |
|---|---|
| InChI | InChI=1S/C8H13NO3/c1-3-9-5-6(4-7(9)10)8(11)12-2/h6H,3-5H2,1-2H3 |
| InChIKey | YGAROMNNYOLXKI-UHFFFAOYSA-N |
| Mol Weight | 171.2 g/mol |
| Molecular Formula | C8H13NO3 |
| Exact Mass | 171.089543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C6nJurvk0Y8 |
|---|---|
| Name | 1-Ethyl-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 | 171.089543280 u |
| Formula | C8H13NO3 |
| InChI | InChI=1S/C8H13NO3/c1-3-9-5-6(4-7(9)10)8(11)12-2/h6H,3-5H2,1-2H3 |
| InChIKey | YGAROMNNYOLXKI-UHFFFAOYSA-N |
| Molecular Weight | 171.196 g/mol |
| SMILES | C1N(C(CC1C(=O)OC)=O)CC |