| SpectraBase Compound ID | GpTWojBprUi |
|---|---|
| InChI | InChI=1S/C9H15F3O3/c1-7(5-3-4-6-14-2)15-8(13)9(10,11)12/h7H,3-6H2,1-2H3 |
| InChIKey | PXDSNTOJBMLRAK-UHFFFAOYSA-N |
| Mol Weight | 228.21 g/mol |
| Molecular Formula | C9H15F3O3 |
| Exact Mass | 228.097329 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 | 8PnDBvfwiRt |
|---|---|
| Name | 1-Methoxy-5-trifluoroacetoxyhexane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.097328829 u |
| Formula | C9H15F3O3 |
| InChI | InChI=1S/C9H15F3O3/c1-7(5-3-4-6-14-2)15-8(13)9(10,11)12/h7H,3-6H2,1-2H3 |
| InChIKey | PXDSNTOJBMLRAK-UHFFFAOYSA-N |
| Molecular Weight | 228.211 g/mol |
| SMILES | COCCCCC(OC(=O)C(F)(F)F)C |