| SpectraBase Compound ID | 9xijK1TJL9D |
|---|---|
| InChI | InChI=1S/C16H20FNO3/c1-2-3-10-21-16(20)14-8-5-9-18(14)15(19)12-6-4-7-13(17)11-12/h4,6-7,11,14H,2-3,5,8-10H2,1H3 |
| InChIKey | CVWIFRWWLJUYQQ-UHFFFAOYSA-N |
| Mol Weight | 293.34 g/mol |
| Molecular Formula | C16H20FNO3 |
| Exact Mass | 293.142722 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HY2IP2nudWo |
|---|---|
| Name | L-Proline, N-(3-fluorobenzoyl)-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 293.142721668 u |
| Formula | C16H20FNO3 |
| InChI | InChI=1S/C16H20FNO3/c1-2-3-10-21-16(20)14-8-5-9-18(14)15(19)12-6-4-7-13(17)11-12/h4,6-7,11,14H,2-3,5,8-10H2,1H3 |
| InChIKey | CVWIFRWWLJUYQQ-UHFFFAOYSA-N |
| Molecular Weight | 293.338 g/mol |
| SMILES | C1(=CC(=CC=C1)F)C(N1CCCC1C(OCCCC)=O)=O |