| SpectraBase Compound ID | 61TMpec0Ft6 |
|---|---|
| InChI | InChI=1S/C9H11F3O2/c1-3-5-7(6-4-2)14-8(13)9(10,11)12/h3-4,7H,1-2,5-6H2 |
| InChIKey | VOIOLVJUKBWWLY-UHFFFAOYSA-N |
| Mol Weight | 208.18 g/mol |
| Molecular Formula | C9H11F3O2 |
| Exact Mass | 208.071114 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JIY5i9WTBCZ |
|---|---|
| Name | 1,6-Heptadien-4-ol, trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.071114081 u |
| Formula | C9H11F3O2 |
| InChI | InChI=1S/C9H11F3O2/c1-3-5-7(6-4-2)14-8(13)9(10,11)12/h3-4,7H,1-2,5-6H2 |
| InChIKey | VOIOLVJUKBWWLY-UHFFFAOYSA-N |
| Molecular Weight | 208.180 g/mol |
| SMILES | C=CCC(CC=C)OC(C(F)(F)F)=O |