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2-(benzenesulfonyl)-3-benzoyl-1,4-benzoquinone
SpectraBase Compound ID CdBmqj4OX67
InChI InChI=1S/C19H12O5S/c20-15-11-12-16(21)19(25(23,24)14-9-5-2-6-10-14)17(15)18(22)13-7-3-1-4-8-13/h1-12H
InChIKey DKCCJTHPUFMNRK-UHFFFAOYSA-N
Mol Weight 352.36 g/mol
Molecular Formula C19H12O5S
Exact Mass 352.040545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1rTOLXVssUq
Name 2-(benzenesulfonyl)-3-benzoyl-1,4-benzoquinone
Comments Less than 3 mono-isotopic peaks
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Formula C19H12O5S
InChI InChI=1S/C19H12O5S/c20-15-11-12-16(21)19(25(23,24)14-9-5-2-6-10-14)17(15)18(22)13-7-3-1-4-8-13/h1-12H
InChIKey DKCCJTHPUFMNRK-UHFFFAOYSA-N
Molecular Weight 352.360 g/mol
SMILES C1(C(=C(C(C=C1)=O)S(=O)(=O)c1ccccc1)C(c1ccccc1)=O)=O
SPLASH splash10-0a4i-0900000000-5fbdce65905baba13948
Source of Spectrum KC-1992-2882-0
Synonyms 2-(benzenesulfonyl)-3-benzoylcyclohexa-2,5-diene-1,4-dione 2-(phenylcarbonyl)-3-(phenylsulfonyl)cyclohexa-2,5-diene-1,4-dione 2-benzoyl-3-besyl-p-benzoquinone
Wiley ID 777084