| SpectraBase Compound ID | 1wJXp5Kbykj |
|---|---|
| InChI | InChI=1S/C19H27NO3/c1-15(2)8-7-13-23-19(22)17-11-6-12-20(17)18(21)14-16-9-4-3-5-10-16/h3-5,9-10,15,17H,6-8,11-14H2,1-2H3 |
| InChIKey | ACCZYRYHDCRGOU-UHFFFAOYSA-N |
| Mol Weight | 317.43 g/mol |
| Molecular Formula | C19H27NO3 |
| Exact Mass | 317.199094 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6SAMaatj6Bo |
|---|---|
| Name | L-Proline, N-(phenylacetyl)-, isohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 317.199093730 u |
| Formula | C19H27NO3 |
| InChI | InChI=1S/C19H27NO3/c1-15(2)8-7-13-23-19(22)17-11-6-12-20(17)18(21)14-16-9-4-3-5-10-16/h3-5,9-10,15,17H,6-8,11-14H2,1-2H3 |
| InChIKey | ACCZYRYHDCRGOU-UHFFFAOYSA-N |
| Molecular Weight | 317.429 g/mol |
| SMILES | C1(=CC=CC=C1)CC(N1CCCC1C(=O)OCCCC(C)C)=O |