| SpectraBase Compound ID | LLUVYn7IfJW |
|---|---|
| InChI | InChI=1S/C9H9F3O/c1-8(13,9(10,11)12)7-5-3-2-4-6-7/h2-6,13H,1H3 |
| InChIKey | HYUUEULUXBVXSG-UHFFFAOYSA-N |
| Mol Weight | 190.17 g/mol |
| Molecular Formula | C9H9F3O |
| Exact Mass | 190.060549 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Oz792e429n |
|---|---|
| Name | 1,1,1-Trifluor-2-phenylpropan-2-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.060549398 u |
| Formula | C9H9F3O |
| InChI | InChI=1S/C9H9F3O/c1-8(13,9(10,11)12)7-5-3-2-4-6-7/h2-6,13H,1H3 |
| InChIKey | HYUUEULUXBVXSG-UHFFFAOYSA-N |
| Molecular Weight | 190.165 g/mol |
| SMILES | OC(c1ccccc1)(C(F)(F)F)C |