| SpectraBase Compound ID | 3lenQ22DhkT |
|---|---|
| InChI | InChI=1S/C10H15F3O2/c1-6-3-4-8(5-7(6)2)15-9(14)10(11,12)13/h6-8H,3-5H2,1-2H3 |
| InChIKey | VHHJIRFTBAIYAS-UHFFFAOYSA-N |
| Mol Weight | 224.22 g/mol |
| Molecular Formula | C10H15F3O2 |
| Exact Mass | 224.102414 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4vfz6MD5wii |
|---|---|
| Name | 1,2-Dimethyl-4-trifluoroacetoxycyclohexane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.102414210 u |
| Formula | C10H15F3O2 |
| InChI | InChI=1S/C10H15F3O2/c1-6-3-4-8(5-7(6)2)15-9(14)10(11,12)13/h6-8H,3-5H2,1-2H3 |
| InChIKey | VHHJIRFTBAIYAS-UHFFFAOYSA-N |
| Molecular Weight | 224.223 g/mol |
| SMILES | C1C(C(CCC1OC(C(F)(F)F)=O)C)C |