| SpectraBase Compound ID | 94FisKnKi1Y |
|---|---|
| InChI | InChI=1S/C14H8Cl4O2/c1-7(19)20-9-4-2-3-8(5-9)10-6-11(15)13(17)14(18)12(10)16/h2-6H,1H3 |
| InChIKey | BSZMGXPMVOSHHO-UHFFFAOYSA-N |
| Mol Weight | 350.0 g/mol |
| Molecular Formula | C14H8Cl4O2 |
| Exact Mass | 347.92784 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HokeZ1u3vNw |
|---|---|
| Name | 3-Hydroxy-2',3',4',5'-tetrachlorobiphenyl, acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 347.927840296 u |
| Formula | C14H8Cl4O2 |
| InChI | InChI=1S/C14H8Cl4O2/c1-7(19)20-9-4-2-3-8(5-9)10-6-11(15)13(17)14(18)12(10)16/h2-6H,1H3 |
| InChIKey | BSZMGXPMVOSHHO-UHFFFAOYSA-N |
| Molecular Weight | 350.028 g/mol |
| SMILES | C1(C2=C(C(=C(C(=C2)Cl)Cl)Cl)Cl)=CC(=CC=C1)OC(C)=O |