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2-(benzenesulfonyl)-1,4-benzoquinone
SpectraBase Compound ID 1wet99dNvw5
InChI InChI=1S/C12H8O4S/c13-9-6-7-11(14)12(8-9)17(15,16)10-4-2-1-3-5-10/h1-8H
InChIKey YLBZMPDRRGZQEN-UHFFFAOYSA-N
Mol Weight 248.25 g/mol
Molecular Formula C12H8O4S
Exact Mass 248.01433 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1eQQSI0PVP
Name 2-(benzenesulfonyl)-1,4-benzoquinone
Alternate Name(s) 2-(benzenesulfonyl)cyclohexa-2,5-diene-1,4-dione 2-(phenylsulfonyl)cyclohexa-2,5-diene-1,4-dione 2-besyl-p-benzoquinone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8O4S
InChI InChI=1S/C12H8O4S/c13-9-6-7-11(14)12(8-9)17(15,16)10-4-2-1-3-5-10/h1-8H
InChIKey YLBZMPDRRGZQEN-UHFFFAOYSA-N
Molecular Weight 248.252 g/mol
SMILES C1(S(=O)(=O)c2ccccc2)=CC(=O)C=CC1=O
SPLASH splash10-001i-0910000000-46383e7f66c36b2b4f11
Source of Spectrum K-127-867-4
Wiley ID 1250702