| SpectraBase Compound ID | 12thOPWPJg |
|---|---|
| InChI | InChI=1S/C4H3F3O3/c1-2(8)10-3(9)4(5,6)7/h1H3 |
| InChIKey | HINSMVRGSUGPBM-UHFFFAOYSA-N |
| Mol Weight | 156.06 g/mol |
| Molecular Formula | C4H3F3O3 |
| Exact Mass | 156.003428 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B0rXnX5aD3Q |
|---|---|
| Name | Acetyl 2,2,2-trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.003428443 u |
| Formula | C4H3F3O3 |
| InChI | InChI=1S/C4H3F3O3/c1-2(8)10-3(9)4(5,6)7/h1H3 |
| InChIKey | HINSMVRGSUGPBM-UHFFFAOYSA-N |
| Molecular Weight | 156.060 g/mol |
| SMILES | C(F)(F)(F)C(=O)OC(=O)C |