| SpectraBase Compound ID | A3uy62j0JWy |
|---|---|
| InChI | InChI=1S/C16H8F6O3/c17-12-4-2-1-3-11(12)13(23)9-5-7-10(8-6-9)25-14(24)15(18,19)16(20,21)22/h1-8H |
| InChIKey | IGVFQAHGVJDLHO-UHFFFAOYSA-N |
| Mol Weight | 362.23 g/mol |
| Molecular Formula | C16H8F6O3 |
| Exact Mass | 362.037763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HxRJHPeZLmY |
|---|---|
| Name | 2-Fluoro-4'-hydroxybenzophenone, pentafluoropropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 362.037763093 u |
| Formula | C16H8F6O3 |
| InChI | InChI=1S/C16H8F6O3/c17-12-4-2-1-3-11(12)13(23)9-5-7-10(8-6-9)25-14(24)15(18,19)16(20,21)22/h1-8H |
| InChIKey | IGVFQAHGVJDLHO-UHFFFAOYSA-N |
| Molecular Weight | 362.227 g/mol |
| SMILES | C1(F)=C(C=CC=C1)C(=O)C1=CC=C(C=C1)OC(C(C(F)(F)F)(F)F)=O |