| SpectraBase Compound ID | 3lxfKAeSTDb |
|---|---|
| InChI | InChI=1S/C11H9F5O3/c12-10(13,11(14,15)16)9(17)19-7-6-18-8-4-2-1-3-5-8/h1-5H,6-7H2 |
| InChIKey | JSGFAINFPLIBHC-UHFFFAOYSA-N |
| Mol Weight | 284.18 g/mol |
| Molecular Formula | C11H9F5O3 |
| Exact Mass | 284.047185 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7zLAKZvw4Uk |
|---|---|
| Name | 2-Phenoxyethanol, pentafluoropropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.047184962 u |
| Formula | C11H9F5O3 |
| InChI | InChI=1S/C11H9F5O3/c12-10(13,11(14,15)16)9(17)19-7-6-18-8-4-2-1-3-5-8/h1-5H,6-7H2 |
| InChIKey | JSGFAINFPLIBHC-UHFFFAOYSA-N |
| Molecular Weight | 284.182 g/mol |
| SMILES | C1=CC=CC=C1OCCOC(=O)C(C(F)(F)F)(F)F |