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2,3-bis(benzenesulfonyl)-5,6-dimethyl-benzene-1,4-diol
SpectraBase Compound ID 1NzLIt5kI2B
InChI InChI=1S/C20H18O6S2/c1-13-14(2)18(22)20(28(25,26)16-11-7-4-8-12-16)19(17(13)21)27(23,24)15-9-5-3-6-10-15/h3-12,21-22H,1-2H3
InChIKey KLZHJNQDNWJDCN-UHFFFAOYSA-N
Mol Weight 418.48 g/mol
Molecular Formula C20H18O6S2
Exact Mass 418.054481 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IeEE9ssGOFJ
Name 2,3-bis(benzenesulfonyl)-5,6-dimethyl-benzene-1,4-diol
Alternate Name(s) 2,3-dibesyl-5,6-dimethyl-hydroquinone 2,3-dimethyl-5,6-bis(phenylsulfonyl)benzene-1,4-diol
Comments Less than 3 mono-isotopic peaks
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Formula C20H18O6S2
InChI InChI=1S/C20H18O6S2/c1-13-14(2)18(22)20(28(25,26)16-11-7-4-8-12-16)19(17(13)21)27(23,24)15-9-5-3-6-10-15/h3-12,21-22H,1-2H3
InChIKey KLZHJNQDNWJDCN-UHFFFAOYSA-N
Molecular Weight 418.478 g/mol
SMILES Oc1c(c(c(c(c1S(=O)(=O)c1ccccc1)S(=O)(=O)c1ccccc1)O)C)C
SPLASH splash10-004i-9000100000-571409c14b4ae103cd3f
Source of Spectrum KC-1992-2881-0
Wiley ID 777092