| SpectraBase Compound ID | 2C4XiM1262h |
|---|---|
| InChI | InChI=1S/C12H21NO3/c1-3-4-5-8-11(14)13-9-6-7-10(13)12(15)16-2/h10H,3-9H2,1-2H3 |
| InChIKey | UJMPCCUZXBIYLS-UHFFFAOYSA-N |
| Mol Weight | 227.3 g/mol |
| Molecular Formula | C12H21NO3 |
| Exact Mass | 227.152144 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KZoU3JOMvHj |
|---|---|
| Name | L-Proline, N-caproyl-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.152143537 u |
| Formula | C12H21NO3 |
| InChI | InChI=1S/C12H21NO3/c1-3-4-5-8-11(14)13-9-6-7-10(13)12(15)16-2/h10H,3-9H2,1-2H3 |
| InChIKey | UJMPCCUZXBIYLS-UHFFFAOYSA-N |
| Molecular Weight | 227.304 g/mol |
| SMILES | CCCCCC(=O)N1CCCC1C(OC)=O |