| SpectraBase Compound ID | 8GZ7nfgYnmg |
|---|---|
| InChI | InChI=1S/C16H12F6O2/c1-24-13-5-3-2-4-12(13)14(23)9-6-10(15(17,18)19)8-11(7-9)16(20,21)22/h2-8,14,23H,1H3 |
| InChIKey | JAXJPJNJDXJFRG-UHFFFAOYSA-N |
| Mol Weight | 350.26 g/mol |
| Molecular Formula | C16H12F6O2 |
| Exact Mass | 350.074149 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5nXZBa2hans |
|---|---|
| Name | (3,5-bis(Trifluoromethyl)phenyl)(2-methoxyphenyl)methanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 350.074148602 u |
| Formula | C16H12F6O2 |
| InChI | InChI=1S/C16H12F6O2/c1-24-13-5-3-2-4-12(13)14(23)9-6-10(15(17,18)19)8-11(7-9)16(20,21)22/h2-8,14,23H,1H3 |
| InChIKey | JAXJPJNJDXJFRG-UHFFFAOYSA-N |
| Molecular Weight | 350.260 g/mol |
| SMILES | C=1(C=C(C(C=2C(=CC=CC2)OC)O)C=C(C1)C(F)(F)F)C(F)(F)F |