| SpectraBase Compound ID | AXod8yLZ4OA |
|---|---|
| InChI | InChI=1S/C12H21F3O2/c1-4-9(5-2)7-8-10(6-3)17-11(16)12(13,14)15/h9-10H,4-8H2,1-3H3 |
| InChIKey | NDBFQXDBQKGMAL-UHFFFAOYSA-N |
| Mol Weight | 254.29 g/mol |
| Molecular Formula | C12H21F3O2 |
| Exact Mass | 254.149364 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4JIBipoSgoX |
|---|---|
| Name | 3-Ethyl-6-trifluoroacetoxyoctane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.149364403 u |
| Formula | C12H21F3O2 |
| InChI | InChI=1S/C12H21F3O2/c1-4-9(5-2)7-8-10(6-3)17-11(16)12(13,14)15/h9-10H,4-8H2,1-3H3 |
| InChIKey | NDBFQXDBQKGMAL-UHFFFAOYSA-N |
| Molecular Weight | 254.293 g/mol |
| SMILES | C(C(CCC(OC(C(F)(F)F)=O)CC)CC)C |