| SpectraBase Compound ID | 3Eh2yLXlpJF |
|---|---|
| InChI | InChI=1S/C12H15FO2/c1-2-3-6-9-15-12(14)10-7-4-5-8-11(10)13/h4-5,7-8H,2-3,6,9H2,1H3 |
| InChIKey | OIQRBBDLMVOBNY-UHFFFAOYSA-N |
| Mol Weight | 210.25 g/mol |
| Molecular Formula | C12H15FO2 |
| Exact Mass | 210.105608 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9ko1CaHydnw |
|---|---|
| Name | 2-Fluorobenzoic acid, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.105607884 u |
| Formula | C12H15FO2 |
| InChI | InChI=1S/C12H15FO2/c1-2-3-6-9-15-12(14)10-7-4-5-8-11(10)13/h4-5,7-8H,2-3,6,9H2,1H3 |
| InChIKey | OIQRBBDLMVOBNY-UHFFFAOYSA-N |
| Molecular Weight | 210.248 g/mol |
| SMILES | CCCCCOC(=O)C1=CC=CC=C1F |