| SpectraBase Compound ID | 6rSnMr1fLs2 |
|---|---|
| InChI | InChI=1S/C15H27F3O2/c1-3-5-6-7-8-9-10-11-12-13(4-2)20-14(19)15(16,17)18/h13H,3-12H2,1-2H3 |
| InChIKey | YSOIFBQBQKWBAM-UHFFFAOYSA-N |
| Mol Weight | 296.37 g/mol |
| Molecular Formula | C15H27F3O2 |
| Exact Mass | 296.196315 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8Y1dc4ZQueO |
|---|---|
| Name | 3-Trifluoroacetoxytridecane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.196314596 u |
| Formula | C15H27F3O2 |
| InChI | InChI=1S/C15H27F3O2/c1-3-5-6-7-8-9-10-11-12-13(4-2)20-14(19)15(16,17)18/h13H,3-12H2,1-2H3 |
| InChIKey | YSOIFBQBQKWBAM-UHFFFAOYSA-N |
| Molecular Weight | 296.374 g/mol |
| SMILES | C(C(CCCCCCCCCC)OC(C(F)(F)F)=O)C |