| SpectraBase Compound ID | Eq3VFN034Tb |
|---|---|
| InChI | InChI=1S/C14H11FO2/c1-10-4-2-7-13(8-10)17-14(16)11-5-3-6-12(15)9-11/h2-9H,1H3 |
| InChIKey | UIXLXXNLGFASHO-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 | 9Modr8jQoAK |
|---|---|
| Name | 3-Fluorobenzoic acid, 3-methylphenyl 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/c1-10-4-2-7-13(8-10)17-14(16)11-5-3-6-12(15)9-11/h2-9H,1H3 |
| InChIKey | UIXLXXNLGFASHO-UHFFFAOYSA-N |
| Molecular Weight | 230.238 g/mol |
| SMILES | C1(=CC=CC(=C1)C(OC=1C=CC=C(C)C1)=O)F |