| SpectraBase Compound ID | Dvf0A2n3vlE |
|---|---|
| InChI | InChI=1S/C13H8Cl4O/c1-18-8-4-2-7(3-5-8)9-6-10(14)12(16)13(17)11(9)15/h2-6H,1H3 |
| InChIKey | ZSHCUOFTDDNSDE-UHFFFAOYSA-N |
| Mol Weight | 322.0 g/mol |
| Molecular Formula | C13H8Cl4O |
| Exact Mass | 319.932926 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3BEZridLDFo |
|---|---|
| Name | 4-Hydroxy-2',3',4',5'-tetrachlorobiphenyl, methyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 319.932925677 u |
| Formula | C13H8Cl4O |
| InChI | InChI=1S/C13H8Cl4O/c1-18-8-4-2-7(3-5-8)9-6-10(14)12(16)13(17)11(9)15/h2-6H,1H3 |
| InChIKey | ZSHCUOFTDDNSDE-UHFFFAOYSA-N |
| Molecular Weight | 322.018 g/mol |
| SMILES | C1(C2=C(C(=C(C(=C2)Cl)Cl)Cl)Cl)=CC=C(C=C1)OC |