| SpectraBase Compound ID | G9nhMXRE03m |
|---|---|
| InChI | InChI=1S/C7H9F3O2/c1-2-3-4-5-12-6(11)7(8,9)10/h2H,1,3-5H2 |
| InChIKey | GRNBTYHGGYTQAM-UHFFFAOYSA-N |
| Mol Weight | 182.14 g/mol |
| Molecular Formula | C7H9F3O2 |
| Exact Mass | 182.055464 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DdQXn0U8SWl |
|---|---|
| Name | 4-Penten-1-ol, trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.055464017 u |
| Formula | C7H9F3O2 |
| InChI | InChI=1S/C7H9F3O2/c1-2-3-4-5-12-6(11)7(8,9)10/h2H,1,3-5H2 |
| InChIKey | GRNBTYHGGYTQAM-UHFFFAOYSA-N |
| Molecular Weight | 182.142 g/mol |
| SMILES | C=CCCCOC(C(F)(F)F)=O |