| SpectraBase Compound ID | 6VyCIAdrjbl |
|---|---|
| InChI | InChI=1S/C17H14Cl4O2/c1-17(2,3)16(22)23-10-6-4-5-9(7-10)13-14(20)11(18)8-12(19)15(13)21/h4-8H,1-3H3 |
| InChIKey | BVUMHQZJOZSIAE-UHFFFAOYSA-N |
| Mol Weight | 392.1 g/mol |
| Molecular Formula | C17H14Cl4O2 |
| Exact Mass | 389.97479 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 39UcDwFlCX8 |
|---|---|
| Name | 3-Hydroxy-2',3',5',6'-tetrachlorobiphenyl, trimethylacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 389.974790489 u |
| Formula | C17H14Cl4O2 |
| InChI | InChI=1S/C17H14Cl4O2/c1-17(2,3)16(22)23-10-6-4-5-9(7-10)13-14(20)11(18)8-12(19)15(13)21/h4-8H,1-3H3 |
| InChIKey | BVUMHQZJOZSIAE-UHFFFAOYSA-N |
| Molecular Weight | 392.109 g/mol |
| SMILES | C1(C2=C(C(=CC(=C2Cl)Cl)Cl)Cl)=CC(=CC=C1)OC(C(C)(C)C)=O |