| SpectraBase Compound ID | DLgxeUQePvF |
|---|---|
| InChI | InChI=1S/C11H15F5O2/c1-3-5-6-7-8(4-2)18-9(17)10(12,13)11(14,15)16/h4,8H,2-3,5-7H2,1H3 |
| InChIKey | QWKJNSPWLFHFQM-UHFFFAOYSA-N |
| Mol Weight | 274.23 g/mol |
| Molecular Formula | C11H15F5O2 |
| Exact Mass | 274.099221 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 73GOZ3qamer |
|---|---|
| Name | 1-Octen-3-ol, pentafluoropropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.099220536 u |
| Formula | C11H15F5O2 |
| InChI | InChI=1S/C11H15F5O2/c1-3-5-6-7-8(4-2)18-9(17)10(12,13)11(14,15)16/h4,8H,2-3,5-7H2,1H3 |
| InChIKey | QWKJNSPWLFHFQM-UHFFFAOYSA-N |
| Molecular Weight | 274.231 g/mol |
| SMILES | CCCCCC(C=C)OC(C(C(F)(F)F)(F)F)=O |