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OCTACHLORO-DIBENZOTHIOPHENE
SpectraBase Compound ID BqggACkM8HX
InChI InChI=1S/C12Cl8S/c13-3-1-2-4(14)6(16)8(18)10(20)12(2)21-11(1)9(19)7(17)5(3)15
InChIKey HCPQUNQDITYIPS-UHFFFAOYSA-N
Mol Weight 459.8 g/mol
Molecular Formula C12Cl8S
Exact Mass 455.722893 g/mol
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
NMR spectroscopy in environmental chemistry:1H and13C NMR chemical shift assignments of chlorinated dibenzothiophenes based on two-dimensional NMR techniques andab initio MO and DFT/GIAO calculations Magnetic Resonance in Chemistry 1999

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