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methyl-2,6-xylyl sulfone
SpectraBase Compound ID EomS7ouyrzD
InChI InChI=1S/C9H12O2S/c1-7-5-4-6-8(2)9(7)12(3,10)11/h4-6H,1-3H3
InChIKey ZQAWWGSVAZSHBB-UHFFFAOYSA-N
Mol Weight 184.25 g/mol
Molecular Formula C9H12O2S
Exact Mass 184.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8vROA87LkRt
Name 1,3-Dimethyl-2-(methylsulfonyl)benzene
Alternate Name(s) 2-Mesyl-1,3-dimethyl-benzene 1,3-Dimethyl-2-methylsulfonylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O2S
InChI InChI=1S/C9H12O2S/c1-7-5-4-6-8(2)9(7)12(3,10)11/h4-6H,1-3H3
InChIKey ZQAWWGSVAZSHBB-UHFFFAOYSA-N
Molecular Weight 184.253 g/mol
SMILES CS(=O)(=O)c1c(cccc1C)C
SPLASH splash10-0fc0-7900000000-e17a33059ed6d1a2750a
Source of Spectrum K1-2004-4638-20
Wiley ID 1559900