| SpectraBase Compound ID | 3Ui2FO7P7or |
|---|---|
| InChI | InChI=1S/C17H11F5O3/c1-10-7-8-13(25-15(24)16(18,19)17(20,21)22)12(9-10)14(23)11-5-3-2-4-6-11/h2-9H,1H3 |
| InChIKey | AZVORSSKHRGQMY-UHFFFAOYSA-N |
| Mol Weight | 358.26 g/mol |
| Molecular Formula | C17H11F5O3 |
| Exact Mass | 358.062835 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | APHSSCfmMox |
|---|---|
| Name | 2-Hydroxy-5-methylbenzophenone, pentafluoropropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 358.062835026 u |
| Formula | C17H11F5O3 |
| InChI | InChI=1S/C17H11F5O3/c1-10-7-8-13(25-15(24)16(18,19)17(20,21)22)12(9-10)14(23)11-5-3-2-4-6-11/h2-9H,1H3 |
| InChIKey | AZVORSSKHRGQMY-UHFFFAOYSA-N |
| Molecular Weight | 358.264 g/mol |
| SMILES | C1(OC(C(C(F)(F)F)(F)F)=O)=C(C=C(C=C1)C)C(=O)C1=CC=CC=C1 |