| SpectraBase Compound ID | DLm0KWPuP6Z |
|---|---|
| InChI | InChI=1S/C13H8ClF3/c14-12-7-3-10(4-8-12)9-1-5-11(6-2-9)13(15,16)17/h1-8H |
| InChIKey | YTFCURBLRVHARJ-UHFFFAOYSA-N |
| Mol Weight | 256.66 g/mol |
| Molecular Formula | C13H8ClF3 |
| Exact Mass | 256.026662 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GCFK1iSLDTc |
|---|---|
| Name | 4-Chloro-4'-(trifluoromethyl)-1,1'-biphenyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.026662447 u |
| Formula | C13H8ClF3 |
| InChI | InChI=1S/C13H8ClF3/c14-12-7-3-10(4-8-12)9-1-5-11(6-2-9)13(15,16)17/h1-8H |
| InChIKey | YTFCURBLRVHARJ-UHFFFAOYSA-N |
| Molecular Weight | 256.655 g/mol |
| SMILES | C=1(C(F)(F)F)C=CC(=CC1)C1=CC=C(C=C1)Cl |