| SpectraBase Compound ID | InBC4hsDQG0 |
|---|---|
| InChI | InChI=1S/C5H2Cl3F5O2/c6-3(7,8)1-15-2(14)4(9,10)5(11,12)13/h1H2 |
| InChIKey | OSKSLSQEVUZXAC-UHFFFAOYSA-N |
| Mol Weight | 295.42 g/mol |
| Molecular Formula | C5H2Cl3F5O2 |
| Exact Mass | 293.904053 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9trQeIgcUmz |
|---|---|
| Name | 2,2,2-Trichloroethanol, pentafluoropropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 293.904053217 u |
| Formula | C5H2Cl3F5O2 |
| InChI | InChI=1S/C5H2Cl3F5O2/c6-3(7,8)1-15-2(14)4(9,10)5(11,12)13/h1H2 |
| InChIKey | OSKSLSQEVUZXAC-UHFFFAOYSA-N |
| Molecular Weight | 295.420 g/mol |
| SMILES | C(Cl)(Cl)(Cl)COC(C(C(F)(F)F)(F)F)=O |