| SpectraBase Compound ID | 5wEa49eFJsm |
|---|---|
| InChI | InChI=1S/C14H8F4O2/c15-11-8-4-7-10(14(16,17)18)12(11)13(19)20-9-5-2-1-3-6-9/h1-8H |
| InChIKey | LLIQXUKRNOFFHA-UHFFFAOYSA-N |
| Mol Weight | 284.21 g/mol |
| Molecular Formula | C14H8F4O2 |
| Exact Mass | 284.046042 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LPH0yXaMsH2 |
|---|---|
| Name | 2-Fluoro-6-trifluoromethylbenzoic acid, phenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.046042148 u |
| Formula | C14H8F4O2 |
| InChI | InChI=1S/C14H8F4O2/c15-11-8-4-7-10(14(16,17)18)12(11)13(19)20-9-5-2-1-3-6-9/h1-8H |
| InChIKey | LLIQXUKRNOFFHA-UHFFFAOYSA-N |
| Molecular Weight | 284.210 g/mol |
| SMILES | C1=CC=C(C=C1)OC(C1=C(C(F)(F)F)C=CC=C1F)=O |