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2,3,3',4',5,6-Hexachloro-1,1'-biphenyl
SpectraBase Compound ID 1hFPWL0VKCL
InChI InChI=1S/C12H4Cl6/c13-6-2-1-5(3-7(6)14)10-11(17)8(15)4-9(16)12(10)18/h1-4H
InChIKey ZAGRQXMWMRUYRB-UHFFFAOYSA-N
Mol Weight 360.9 g/mol
Molecular Formula C12H4Cl6
Exact Mass 357.844416 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FEznCd5xuBV
Name 2,3,3',4',5,6-Hexachloro-1,1'-biphenyl
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 357.844416329 u
Formula C12H4Cl6
InChI InChI=1S/C12H4Cl6/c13-6-2-1-5(3-7(6)14)10-11(17)8(15)4-9(16)12(10)18/h1-4H
InChIKey ZAGRQXMWMRUYRB-UHFFFAOYSA-N
Molecular Weight 360.882 g/mol
SMILES C1(=C(C(=CC(=C1Cl)Cl)Cl)Cl)C1=CC(=C(C=C1)Cl)Cl