| SpectraBase Compound ID | 8zXjtNvqDi8 |
|---|---|
| InChI | InChI=1S/C10H8BrF3O2/c11-8-4-2-1-3-7(8)5-6-16-9(15)10(12,13)14/h1-4H,5-6H2 |
| InChIKey | ZTRNJXZBJYZXCT-UHFFFAOYSA-N |
| Mol Weight | 297.07 g/mol |
| Molecular Formula | C10H8BrF3O2 |
| Exact Mass | 295.965977 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JMxU1oJcuDG |
|---|---|
| Name | 2-Bromophenethyl alcohol, trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.965976985 u |
| Formula | C10H8BrF3O2 |
| InChI | InChI=1S/C10H8BrF3O2/c11-8-4-2-1-3-7(8)5-6-16-9(15)10(12,13)14/h1-4H,5-6H2 |
| InChIKey | ZTRNJXZBJYZXCT-UHFFFAOYSA-N |
| Molecular Weight | 297.071 g/mol |
| SMILES | C1(=C(C=CC=C1)Br)CCOC(C(F)(F)F)=O |