| SpectraBase Compound ID | Kbq28aVetq7 |
|---|---|
| InChI | InChI=1S/C10H8F4O2/c11-8-3-1-7(2-4-8)5-6-16-9(15)10(12,13)14/h1-4H,5-6H2 |
| InChIKey | XBLNSQJJDJOVQF-UHFFFAOYSA-N |
| Mol Weight | 236.17 g/mol |
| Molecular Formula | C10H8F4O2 |
| Exact Mass | 236.046042 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EeiKeTJJtAD |
|---|---|
| Name | 4-Fluorophenethyl alcohol, trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.046042148 u |
| Formula | C10H8F4O2 |
| InChI | InChI=1S/C10H8F4O2/c11-8-3-1-7(2-4-8)5-6-16-9(15)10(12,13)14/h1-4H,5-6H2 |
| InChIKey | XBLNSQJJDJOVQF-UHFFFAOYSA-N |
| Molecular Weight | 236.166 g/mol |
| SMILES | C1=CC(=CC=C1CCOC(C(F)(F)F)=O)F |