| SpectraBase Compound ID | BjVu1d0dmny |
|---|---|
| InChI | InChI=1S/C15H11F3O2/c1-10(19)20-14-8-4-12(5-9-14)11-2-6-13(7-3-11)15(16,17)18/h2-9H,1H3 |
| InChIKey | CZXYMAROEFKHBK-UHFFFAOYSA-N |
| Mol Weight | 280.25 g/mol |
| Molecular Formula | C15H11F3O2 |
| Exact Mass | 280.071114 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B5USErVqpdI |
|---|---|
| Name | 4-(4-Trifluoromethylphenyl)phenol, acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.071114081 u |
| Formula | C15H11F3O2 |
| InChI | InChI=1S/C15H11F3O2/c1-10(19)20-14-8-4-12(5-9-14)11-2-6-13(7-3-11)15(16,17)18/h2-9H,1H3 |
| InChIKey | CZXYMAROEFKHBK-UHFFFAOYSA-N |
| Molecular Weight | 280.246 g/mol |
| SMILES | C(F)(F)(F)C1=CC=C(C=C1)C1=CC=C(C=C1)OC(C)=O |