| SpectraBase Compound ID | B2f6Hd8MQN5 |
|---|---|
| InChI | InChI=1S/C14H11FO2/c1-10-6-8-11(9-7-10)14(16)17-13-5-3-2-4-12(13)15/h2-9H,1H3 |
| InChIKey | BXSUHAYLKDDMBC-UHFFFAOYSA-N |
| Mol Weight | 230.24 g/mol |
| Molecular Formula | C14H11FO2 |
| Exact Mass | 230.074308 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FL7GhrlSory |
|---|---|
| Name | 4-Methylbenzoic acid, 2-fluorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.074307755 u |
| Formula | C14H11FO2 |
| InChI | InChI=1S/C14H11FO2/c1-10-6-8-11(9-7-10)14(16)17-13-5-3-2-4-12(13)15/h2-9H,1H3 |
| InChIKey | BXSUHAYLKDDMBC-UHFFFAOYSA-N |
| Molecular Weight | 230.238 g/mol |
| SMILES | C1=C(C=CC(=C1)C(OC1=C(C=CC=C1)F)=O)C |