| SpectraBase Compound ID | Dsm3ljCaWuH |
|---|---|
| InChI | InChI=1S/C8H13NO3/c1-2-5-12-8(11)6-3-4-7(10)9-6/h6H,2-5H2,1H3,(H,9,10) |
| InChIKey | BGXWNKLNZHEEMA-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 | BRBWnVKoD84 |
|---|---|
| Name | L-Proline, 5-oxo-, N-propyl 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/c1-2-5-12-8(11)6-3-4-7(10)9-6/h6H,2-5H2,1H3,(H,9,10) |
| InChIKey | BGXWNKLNZHEEMA-UHFFFAOYSA-N |
| Molecular Weight | 171.196 g/mol |
| SMILES | C1(NC(=O)CC1)C(OCCC)=O |