| SpectraBase Compound ID | FPpStRSgYU |
|---|---|
| InChI | InChI=1S/C15H9F5O2/c16-14(17,15(18,19)20)13(21)22-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H |
| InChIKey | AZNYDSUEGNGTMP-UHFFFAOYSA-N |
| Mol Weight | 316.23 g/mol |
| Molecular Formula | C15H9F5O2 |
| Exact Mass | 316.05227 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6IIJ74iVhz7 |
|---|---|
| Name | 4-Phenylphenol, pentafluoropropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.052270343 u |
| Formula | C15H9F5O2 |
| InChI | InChI=1S/C15H9F5O2/c16-14(17,15(18,19)20)13(21)22-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H |
| InChIKey | AZNYDSUEGNGTMP-UHFFFAOYSA-N |
| Molecular Weight | 316.227 g/mol |
| SMILES | C1=CC(=CC=C1OC(C(C(F)(F)F)(F)F)=O)C1=CC=CC=C1 |