| SpectraBase Compound ID | 5d3hyQNzSGv |
|---|---|
| InChI | InChI=1S/C12H5Cl5O/c13-6-3-5(1-2-9(6)18)10-11(16)7(14)4-8(15)12(10)17/h1-4,18H |
| InChIKey | VQCLALDVRKEBBH-UHFFFAOYSA-N |
| Mol Weight | 342.4 g/mol |
| Molecular Formula | C12H5Cl5O |
| Exact Mass | 339.878303 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KRqcpNNlylt |
|---|---|
| Name | 4-Hydroxy-2',3,3',5',6'-pentachlorobiphenyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.878303280 u |
| Formula | C12H5Cl5O |
| InChI | InChI=1S/C12H5Cl5O/c13-6-3-5(1-2-9(6)18)10-11(16)7(14)4-8(15)12(10)17/h1-4,18H |
| InChIKey | VQCLALDVRKEBBH-UHFFFAOYSA-N |
| Molecular Weight | 342.436 g/mol |
| SMILES | C1(C2=C(C(=CC(=C2Cl)Cl)Cl)Cl)=CC(=C(C=C1)O)Cl |