| SpectraBase Compound ID | I1q0yf1tSOm |
|---|---|
| InChI | InChI=1S/C9H6BrF3O2/c10-7-4-2-1-3-6(7)5-15-8(14)9(11,12)13/h1-4H,5H2 |
| InChIKey | HVZBZVCGGIBXLO-UHFFFAOYSA-N |
| Mol Weight | 283.04 g/mol |
| Molecular Formula | C9H6BrF3O2 |
| Exact Mass | 281.950327 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | MUW20eOdNd |
|---|---|
| Name | 2-Bromobenzyl alcohol, trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.950326920 u |
| Formula | C9H6BrF3O2 |
| InChI | InChI=1S/C9H6BrF3O2/c10-7-4-2-1-3-6(7)5-15-8(14)9(11,12)13/h1-4H,5H2 |
| InChIKey | HVZBZVCGGIBXLO-UHFFFAOYSA-N |
| Molecular Weight | 283.044 g/mol |
| SMILES | C1(=CC=CC=C1COC(C(F)(F)F)=O)Br |