| SpectraBase Compound ID | GVulAmYZwsB |
|---|---|
| InChI | InChI=1S/C11H6F6O4/c12-10(13,14)8(18)20-5-6-2-1-3-7(4-6)21-9(19)11(15,16)17/h1-4H,5H2 |
| InChIKey | OHASXCZQAZMRJR-UHFFFAOYSA-N |
| Mol Weight | 316.16 g/mol |
| Molecular Formula | C11H6F6O4 |
| Exact Mass | 316.017028 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7AfaARIAXjk |
|---|---|
| Name | 3-Hydroxybenzyl alcohol, bis(trifluoroacetate) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.017027647 u |
| Formula | C11H6F6O4 |
| InChI | InChI=1S/C11H6F6O4/c12-10(13,14)8(18)20-5-6-2-1-3-7(4-6)21-9(19)11(15,16)17/h1-4H,5H2 |
| InChIKey | OHASXCZQAZMRJR-UHFFFAOYSA-N |
| Molecular Weight | 316.155 g/mol |
| SMILES | C1=C(C=CC=C1COC(C(F)(F)F)=O)OC(C(F)(F)F)=O |