| SpectraBase Compound ID | FiccG8chIjE |
|---|---|
| InChI | InChI=1S/C10H13F3O6/c1-9(2)17-4-5(19-9)6(7(14)16-3)18-8(15)10(11,12)13/h5-6H,4H2,1-3H3 |
| InChIKey | GRZCYWPMVKLKEU-UHFFFAOYSA-N |
| Mol Weight | 286.2 g/mol |
| Molecular Formula | C10H13F3O6 |
| Exact Mass | 286.066423 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HrZYeTi7iVJ |
|---|---|
| Name | Methyl 3,4-o-isopropylidene-L-threonate, trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.066422622 u |
| Formula | C10H13F3O6 |
| InChI | InChI=1S/C10H13F3O6/c1-9(2)17-4-5(19-9)6(7(14)16-3)18-8(15)10(11,12)13/h5-6H,4H2,1-3H3 |
| InChIKey | GRZCYWPMVKLKEU-UHFFFAOYSA-N |
| Molecular Weight | 286.203 g/mol |
| SMILES | C1(OC(C(C(=O)OC)OC(C(F)(F)F)=O)CO1)(C)C |