| SpectraBase Compound ID | 2WoEVezamEV |
|---|---|
| InChI | InChI=1S/C20H29NO3/c1-2-3-4-8-16-24-20(23)18-12-9-15-21(18)19(22)14-13-17-10-6-5-7-11-17/h5-7,10-11,18H,2-4,8-9,12-16H2,1H3 |
| InChIKey | PZRZLTOHEZJRHG-UHFFFAOYSA-N |
| Mol Weight | 331.46 g/mol |
| Molecular Formula | C20H29NO3 |
| Exact Mass | 331.214744 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GqYIECGty4T |
|---|---|
| Name | L-Proline, N-(3-phenylpropionyl)-, hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 331.214743795 u |
| Formula | C20H29NO3 |
| InChI | InChI=1S/C20H29NO3/c1-2-3-4-8-16-24-20(23)18-12-9-15-21(18)19(22)14-13-17-10-6-5-7-11-17/h5-7,10-11,18H,2-4,8-9,12-16H2,1H3 |
| InChIKey | PZRZLTOHEZJRHG-UHFFFAOYSA-N |
| Molecular Weight | 331.456 g/mol |
| SMILES | C1=CC=CC(=C1)CCC(N1CCCC1C(=O)OCCCCCC)=O |