| SpectraBase Compound ID | ppc1cIHYRi |
|---|---|
| InChI | InChI=1S/C18H18F4/c1-2-3-4-5-6-12-7-9-13(10-8-12)16-17(21)14(19)11-15(20)18(16)22/h7-11H,2-6H2,1H3 |
| InChIKey | WKRUKUIAQZDCNH-UHFFFAOYSA-N |
| Mol Weight | 310.34 g/mol |
| Molecular Formula | C18H18F4 |
| Exact Mass | 310.134463 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1ifAH69RRob |
|---|---|
| Name | 1,2,4,5-Tetrafluoro-3-(4-hexylphenyl)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.134463232 u |
| Formula | C18H18F4 |
| InChI | InChI=1S/C18H18F4/c1-2-3-4-5-6-12-7-9-13(10-8-12)16-17(21)14(19)11-15(20)18(16)22/h7-11H,2-6H2,1H3 |
| InChIKey | WKRUKUIAQZDCNH-UHFFFAOYSA-N |
| Molecular Weight | 310.336 g/mol |
| SMILES | C=1(C(=C(F)C=C(C1F)F)F)C=1C=CC(=CC1)CCCCCC |