| SpectraBase Compound ID | 65wd7wldGpY |
|---|---|
| InChI | InChI=1S/C13H7F5/c1-6-2-4-7(5-3-6)8-9(14)11(16)13(18)12(17)10(8)15/h2-5H,1H3 |
| InChIKey | PWMDTYMKSMKJRY-UHFFFAOYSA-N |
| Mol Weight | 258.19 g/mol |
| Molecular Formula | C13H7F5 |
| Exact Mass | 258.046791 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G9rH80Zod6d |
|---|---|
| Name | 2,3,4,5,6-Pentafluoro-4'-methyl-1,1'-biphenyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.046791040 u |
| Formula | C13H7F5 |
| InChI | InChI=1S/C13H7F5/c1-6-2-4-7(5-3-6)8-9(14)11(16)13(18)12(17)10(8)15/h2-5H,1H3 |
| InChIKey | PWMDTYMKSMKJRY-UHFFFAOYSA-N |
| Molecular Weight | 258.191 g/mol |
| SMILES | C=1C(=CC=C(C1)C=1C(=C(C(=C(F)C1F)F)F)F)C |