| SpectraBase Compound ID | B2DWkIlF9RR |
|---|---|
| InChI | InChI=1S/C14H11F3O/c1-18-13-7-5-10(6-8-13)11-3-2-4-12(9-11)14(15,16)17/h2-9H,1H3 |
| InChIKey | PLCMWCLPLSJTEH-UHFFFAOYSA-N |
| Mol Weight | 252.24 g/mol |
| Molecular Formula | C14H11F3O |
| Exact Mass | 252.076199 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IfCsTCrpCe8 |
|---|---|
| Name | 4'-Methoxy-3-(trifluoromethyl)-biphenyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.076199462 u |
| Formula | C14H11F3O |
| InChI | InChI=1S/C14H11F3O/c1-18-13-7-5-10(6-8-13)11-3-2-4-12(9-11)14(15,16)17/h2-9H,1H3 |
| InChIKey | PLCMWCLPLSJTEH-UHFFFAOYSA-N |
| Molecular Weight | 252.236 g/mol |
| SMILES | C(F)(C=1C=C(C2=CC=C(C=C2)OC)C=CC1)(F)F |