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3-Methylsulfonyl-3',6'-dichlorobiphenyl
SpectraBase Compound ID 7vw6FWX5VOe
InChI InChI=1S/C13H10Cl2O2S/c1-18(16,17)11-4-2-3-9(7-11)12-8-10(14)5-6-13(12)15/h2-8H,1H3
InChIKey BIBGCEIYFCGELT-UHFFFAOYSA-N
Mol Weight 301.19 g/mol
Molecular Formula C13H10Cl2O2S
Exact Mass 299.977856 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4HgGvAdWuqn
Name 3-Methylsulfonyl-3',6'-dichlorobiphenyl
Alternate Name(s) 2',5'-dichloro[1,1'-biphenyl]-3-yl methyl sulfone 2,5-Dichloro-3'-(methylsulfonyl)-1,1'-biphenyl
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Formula C13H10Cl2O2S
InChI InChI=1S/C13H10Cl2O2S/c1-18(16,17)11-4-2-3-9(7-11)12-8-10(14)5-6-13(12)15/h2-8H,1H3
InChIKey BIBGCEIYFCGELT-UHFFFAOYSA-N
Molecular Weight 301.187 g/mol
SMILES c1(S(=O)(=O)C)cc(-c2c(ccc(c2)Cl)Cl)ccc1
SPLASH splash10-0f79-0956000000-f1e8f1f2232d6a75e27c
Source of Spectrum KO-7-24-2
Wiley ID 1302428