| SpectraBase Compound ID | DiKKof3VUYn |
|---|---|
| InChI | InChI=1S/C8H9F5O2/c1-5(2)3-4-15-6(14)7(9,10)8(11,12)13/h3H,4H2,1-2H3 |
| InChIKey | IHVNTTPIHTZFEC-UHFFFAOYSA-N |
| Mol Weight | 232.15 g/mol |
| Molecular Formula | C8H9F5O2 |
| Exact Mass | 232.05227 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BxwxgfM8rTD |
|---|---|
| Name | 3-Methyl-2-buten-1-ol, pentafluoropropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.052270343 u |
| Formula | C8H9F5O2 |
| InChI | InChI=1S/C8H9F5O2/c1-5(2)3-4-15-6(14)7(9,10)8(11,12)13/h3H,4H2,1-2H3 |
| InChIKey | IHVNTTPIHTZFEC-UHFFFAOYSA-N |
| Molecular Weight | 232.150 g/mol |
| SMILES | CC(C)=CCOC(C(C(F)(F)F)(F)F)=O |