SpectraBase Compound ID | FWEV0jOHvKW |
---|---|
InChI | InChI=1S/C12H4Cl4S/c13-5-1-7-8-2-6(14)4-10(16)12(8)17-11(7)9(15)3-5/h1-4H |
InChIKey | XDHNCYZIZUPLLK-UHFFFAOYSA-N |
Mol Weight | 322.0 g/mol |
Molecular Formula | C12H4Cl4S |
Exact Mass | 319.878782 g/mol |
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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