SpectraBase Compound ID | L9CA4vUafsh |
---|---|
InChI | InChI=1S/C12H4Cl4S/c13-5-1-7-6-3-8(14)9(15)4-11(6)17-12(7)10(16)2-5/h1-4H |
InChIKey | ITYQTSPJOTWUFV-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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