| SpectraBase Compound ID | 5JfPssLMpIi |
|---|---|
| InChI | InChI=1S/C13H25NO2/c1-3-5-9-14-10-7-8-12(14)13(15)16-11-6-4-2/h12H,3-11H2,1-2H3 |
| InChIKey | CJVQNEZAESXEKV-UHFFFAOYSA-N |
| Mol Weight | 227.35 g/mol |
| Molecular Formula | C13H25NO2 |
| Exact Mass | 227.188529 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1PIp2rRwG40 |
|---|---|
| Name | L-Proline, N-butyl-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.188529047 u |
| Formula | C13H25NO2 |
| InChI | InChI=1S/C13H25NO2/c1-3-5-9-14-10-7-8-12(14)13(15)16-11-6-4-2/h12H,3-11H2,1-2H3 |
| InChIKey | CJVQNEZAESXEKV-UHFFFAOYSA-N |
| Molecular Weight | 227.348 g/mol |
| SMILES | C(OCCCC)(=O)C1CCCN1CCCC |