| SpectraBase Compound ID | JEA4IUwJQls |
|---|---|
| InChI | InChI=1S/C16H8F6O4/c17-15(18,19)13(23)25-11-7-3-1-5-9(11)10-6-2-4-8-12(10)26-14(24)16(20,21)22/h1-8H |
| InChIKey | FNSAFZWTQQMYIK-UHFFFAOYSA-N |
| Mol Weight | 378.23 g/mol |
| Molecular Formula | C16H8F6O4 |
| Exact Mass | 378.032678 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8Kf8kJ3iTt8 |
|---|---|
| Name | 2,2'-Dihydroxybiphenyl, trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 378.032677712 u |
| Formula | C16H8F6O4 |
| InChI | InChI=1S/C16H8F6O4/c17-15(18,19)13(23)25-11-7-3-1-5-9(11)10-6-2-4-8-12(10)26-14(24)16(20,21)22/h1-8H |
| InChIKey | FNSAFZWTQQMYIK-UHFFFAOYSA-N |
| Molecular Weight | 378.226 g/mol |
| SMILES | C1(=C(C=CC=C1)OC(C(F)(F)F)=O)C1=C(C=CC=C1)OC(C(F)(F)F)=O |