| SpectraBase Compound ID | IYq06zZf0eW |
|---|---|
| InChI | InChI=1S/C16H15F3O/c17-16(18,19)14-9-7-13(8-10-14)15(20)11-6-12-4-2-1-3-5-12/h1-5,7-10,15,20H,6,11H2 |
| InChIKey | DJHVBJANEQRHBK-UHFFFAOYSA-N |
| Mol Weight | 280.29 g/mol |
| Molecular Formula | C16H15F3O |
| Exact Mass | 280.1075 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GAu4voE2evr |
|---|---|
| Name | 3-Phenyl-1-(4-trifluoromethylphenyl)-1-propanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.107499591 u |
| Formula | C16H15F3O |
| InChI | InChI=1S/C16H15F3O/c17-16(18,19)14-9-7-13(8-10-14)15(20)11-6-12-4-2-1-3-5-12/h1-5,7-10,15,20H,6,11H2 |
| InChIKey | DJHVBJANEQRHBK-UHFFFAOYSA-N |
| Molecular Weight | 280.290 g/mol |
| SMILES | C=1C=C(C(CCC2=CC=CC=C2)O)C=CC1C(F)(F)F |