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1,2,3,4,6,7,8-HEPTACHLORO-DIBENZOTHIOPHENE
SpectraBase Compound ID 6XWzMhy9E44
InChI InChI=1S/C12HCl7S/c13-3-1-2-4-6(15)7(16)8(17)10(19)12(4)20-11(2)9(18)5(3)14/h1H
InChIKey LPPTVBOUIAQBSN-UHFFFAOYSA-N
Mol Weight 425.4 g/mol
Molecular Formula C12HCl7S
Exact Mass 421.761865 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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