| SpectraBase Compound ID | 2CgPUMkiyKl |
|---|---|
| InChI | InChI=1S/C22H33NO3/c1-2-3-4-5-6-7-11-17-26-22(25)20-15-12-16-23(20)21(24)18-19-13-9-8-10-14-19/h8-10,13-14,20H,2-7,11-12,15-18H2,1H3 |
| InChIKey | WVHSIKPTGWXWAH-UHFFFAOYSA-N |
| Mol Weight | 359.5 g/mol |
| Molecular Formula | C22H33NO3 |
| Exact Mass | 359.246044 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DAcYPI5XyRQ |
|---|---|
| Name | L-Proline, N-(phenylacetyl)-, nonyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 359.246043924 u |
| Formula | C22H33NO3 |
| InChI | InChI=1S/C22H33NO3/c1-2-3-4-5-6-7-11-17-26-22(25)20-15-12-16-23(20)21(24)18-19-13-9-8-10-14-19/h8-10,13-14,20H,2-7,11-12,15-18H2,1H3 |
| InChIKey | WVHSIKPTGWXWAH-UHFFFAOYSA-N |
| Molecular Weight | 359.510 g/mol |
| SMILES | C1(=CC=CC=C1)CC(N1CCCC1C(=O)OCCCCCCCCC)=O |