| SpectraBase Compound ID | FLh2WJtpc85 |
|---|---|
| InChI | InChI=1S/C11H7F7O2/c1-20-7-4-2-6(3-5-7)8(19)9(12,13)10(14,15)11(16,17)18/h2-5H,1H3 |
| InChIKey | HKZZKJHRHPACDM-UHFFFAOYSA-N |
| Mol Weight | 304.16 g/mol |
| Molecular Formula | C11H7F7O2 |
| Exact Mass | 304.033427 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GYikwh0Ilm3 |
|---|---|
| Name | 2,2,3,3,4,4,4-Heptafluoro-1-(4-methoxyphenyl)-1-butanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.033426604 u |
| Formula | C11H7F7O2 |
| InChI | InChI=1S/C11H7F7O2/c1-20-7-4-2-6(3-5-7)8(19)9(12,13)10(14,15)11(16,17)18/h2-5H,1H3 |
| InChIKey | HKZZKJHRHPACDM-UHFFFAOYSA-N |
| Molecular Weight | 304.164 g/mol |
| SMILES | C(=O)(C(C(C(F)(F)F)(F)F)(F)F)C=1C=CC(=CC1)OC |