| SpectraBase Compound ID | 2fvnhuIo2yr |
|---|---|
| InChI | InChI=1S/C12H6Cl4O/c13-7-1-2-9(14)8(5-7)6-3-10(15)12(17)11(16)4-6/h1-5,17H |
| InChIKey | XKKCINSXSUTMIS-UHFFFAOYSA-N |
| Mol Weight | 308.0 g/mol |
| Molecular Formula | C12H6Cl4O |
| Exact Mass | 305.917276 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cqo1Nb1W532 |
|---|---|
| Name | 4-Hydroxy-2',3,5,5'-tetrachlorobiphenyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 305.917275612 u |
| Formula | C12H6Cl4O |
| InChI | InChI=1S/C12H6Cl4O/c13-7-1-2-9(14)8(5-7)6-3-10(15)12(17)11(16)4-6/h1-5,17H |
| InChIKey | XKKCINSXSUTMIS-UHFFFAOYSA-N |
| Molecular Weight | 307.991 g/mol |
| SMILES | C1(C2=C(C=CC(=C2)Cl)Cl)=CC(=C(C(=C1)Cl)O)Cl |