| SpectraBase Compound ID | 455QqAKHfzg |
|---|---|
| InChI | InChI=1S/C14H8Cl4O2/c1-7(19)20-9-4-2-3-8(5-9)12-13(17)10(15)6-11(16)14(12)18/h2-6H,1H3 |
| InChIKey | LFFJUYZAMKRRDB-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 | Lkq5F8gauO |
|---|---|
| Name | 3-Hydroxy-2',3',5',6'-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)12-13(17)10(15)6-11(16)14(12)18/h2-6H,1H3 |
| InChIKey | LFFJUYZAMKRRDB-UHFFFAOYSA-N |
| Molecular Weight | 350.028 g/mol |
| SMILES | C1(C2=C(C(=CC(=C2Cl)Cl)Cl)Cl)=CC(=CC=C1)OC(C)=O |