| SpectraBase Compound ID | BQ2Wr37ThgD |
|---|---|
| InChI | InChI=1S/C13H7F5O/c1-19-7-4-2-6(3-5-7)8-9(14)11(16)13(18)12(17)10(8)15/h2-5H,1H3 |
| InChIKey | XVJYMAJQZQCYNH-UHFFFAOYSA-N |
| Mol Weight | 274.19 g/mol |
| Molecular Formula | C13H7F5O |
| Exact Mass | 274.041706 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JjjWiteXvAW |
|---|---|
| Name | 2,3,4,5,6-Pentafluoro-4'-methoxy-1,1'-biphenyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.041705659 u |
| Formula | C13H7F5O |
| InChI | InChI=1S/C13H7F5O/c1-19-7-4-2-6(3-5-7)8-9(14)11(16)13(18)12(17)10(8)15/h2-5H,1H3 |
| InChIKey | XVJYMAJQZQCYNH-UHFFFAOYSA-N |
| Molecular Weight | 274.190 g/mol |
| SMILES | C=1C(=CC=C(C1)C=1C(=C(C(=C(F)C1F)F)F)F)OC |