| SpectraBase Compound ID | DRuersKEIUB |
|---|---|
| InChI | InChI=1S/C9H13F3O2/c10-9(11,12)8(13)14-6-7-4-2-1-3-5-7/h7H,1-6H2 |
| InChIKey | BASFQMGHOQLQQV-UHFFFAOYSA-N |
| Mol Weight | 210.2 g/mol |
| Molecular Formula | C9H13F3O2 |
| Exact Mass | 210.086764 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4tzHuHGSvsF |
|---|---|
| Name | Cyclohexylmethanol, trifluoroacetate (ester) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.086764146 u |
| Formula | C9H13F3O2 |
| InChI | InChI=1S/C9H13F3O2/c10-9(11,12)8(13)14-6-7-4-2-1-3-5-7/h7H,1-6H2 |
| InChIKey | BASFQMGHOQLQQV-UHFFFAOYSA-N |
| Molecular Weight | 210.196 g/mol |
| SMILES | C(F)(F)(F)C(=O)OCC1CCCCC1 |