| SpectraBase Compound ID | JXtmkyiDOEQ |
|---|---|
| InChI | InChI=1S/C14H25NO3/c1-3-4-5-6-7-10-13(16)15-11-8-9-12(15)14(17)18-2/h12H,3-11H2,1-2H3 |
| InChIKey | PIIYQBLKPQBPRB-UHFFFAOYSA-N |
| Mol Weight | 255.36 g/mol |
| Molecular Formula | C14H25NO3 |
| Exact Mass | 255.183444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3stDcxuvCyl |
|---|---|
| Name | L-Proline, N-capryloyl-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 255.183443666 u |
| Formula | C14H25NO3 |
| InChI | InChI=1S/C14H25NO3/c1-3-4-5-6-7-10-13(16)15-11-8-9-12(15)14(17)18-2/h12H,3-11H2,1-2H3 |
| InChIKey | PIIYQBLKPQBPRB-UHFFFAOYSA-N |
| Molecular Weight | 255.358 g/mol |
| SMILES | CCCCCCCC(N1CCCC1C(OC)=O)=O |