| SpectraBase Compound ID | Ajbc8sI3C71 |
|---|---|
| InChI | InChI=1S/C13H15F5O2/c1-3-7(2)6-19-4-5-20-13-11(17)9(15)8(14)10(16)12(13)18/h7H,3-6H2,1-2H3 |
| InChIKey | FWYSMAQCEQBXKF-UHFFFAOYSA-N |
| Mol Weight | 298.25 g/mol |
| Molecular Formula | C13H15F5O2 |
| Exact Mass | 298.099221 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ionxkO5DnY |
|---|---|
| Name | 2-(Pentafluorophenoxy)ethanol, 2-methylbutyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.099220536 u |
| Formula | C13H15F5O2 |
| InChI | InChI=1S/C13H15F5O2/c1-3-7(2)6-19-4-5-20-13-11(17)9(15)8(14)10(16)12(13)18/h7H,3-6H2,1-2H3 |
| InChIKey | FWYSMAQCEQBXKF-UHFFFAOYSA-N |
| Molecular Weight | 298.253 g/mol |
| SMILES | C1(=C(C(=C(C(=C1F)F)F)OCCOCC(CC)C)F)F |