| SpectraBase Compound ID | 3nhFMxF0kBg |
|---|---|
| InChI | InChI=1S/C17H23NO3/c1-3-4-11-21-17(20)15-9-6-10-18(15)16(19)14-8-5-7-13(2)12-14/h5,7-8,12,15H,3-4,6,9-11H2,1-2H3 |
| InChIKey | WEHNQKOYSYMKOH-UHFFFAOYSA-N |
| Mol Weight | 289.38 g/mol |
| Molecular Formula | C17H23NO3 |
| Exact Mass | 289.167794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I51AbPjnn2I |
|---|---|
| Name | L-Proline, N-(3-methylbenzoyl)-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.167793602 u |
| Formula | C17H23NO3 |
| InChI | InChI=1S/C17H23NO3/c1-3-4-11-21-17(20)15-9-6-10-18(15)16(19)14-8-5-7-13(2)12-14/h5,7-8,12,15H,3-4,6,9-11H2,1-2H3 |
| InChIKey | WEHNQKOYSYMKOH-UHFFFAOYSA-N |
| SMILES | C1(=CC=CC(=C1)C(N1CCCC1C(=O)OCCCC)=O)C |