| SpectraBase Compound ID | 8iBaIghIhXU |
|---|---|
| InChI | InChI=1S/C10H12F6O4/c1-2-3-4-6(20-8(18)10(14,15)16)5-19-7(17)9(11,12)13/h6H,2-5H2,1H3 |
| InChIKey | CDJPDFXVAQSHQY-UHFFFAOYSA-N |
| Mol Weight | 310.19 g/mol |
| Molecular Formula | C10H12F6O4 |
| Exact Mass | 310.063978 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IerCN8hu0GQ |
|---|---|
| Name | 1,2-di(Trifluoroacetoxy)hexane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.063977840 u |
| Formula | C10H12F6O4 |
| InChI | InChI=1S/C10H12F6O4/c1-2-3-4-6(20-8(18)10(14,15)16)5-19-7(17)9(11,12)13/h6H,2-5H2,1H3 |
| InChIKey | CDJPDFXVAQSHQY-UHFFFAOYSA-N |
| Molecular Weight | 310.192 g/mol |
| SMILES | C(CCC)C(COC(=O)C(F)(F)F)OC(=O)C(F)(F)F |