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4-Ethylbenzenesulfonic acid
SpectraBase Compound ID EEdYSkF0p3U
InChI InChI=1S/C8H10O3S/c1-2-7-3-5-8(6-4-7)12(9,10)11/h3-6H,2H2,1H3,(H,9,10,11)
InChIKey BRIXOPDYGQCZFO-UHFFFAOYSA-N
Mol Weight 186.22 g/mol
Molecular Formula C8H10O3S
Exact Mass 186.035065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID RFOCPDjj64
Name 4-Ethylbenzenesulfonic acid
Alternate Name(s) 4-Ethylbesylic acid Benzenesulfonic acid, 4-ethyl- p-Ethylbenzenesulfonic acid
CAS Registry Number 98-69-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10O3S
InChI InChI=1S/C8H10O3S/c1-2-7-3-5-8(6-4-7)12(9,10)11/h3-6H,2H2,1H3,(H,9,10,11)
InChIKey BRIXOPDYGQCZFO-UHFFFAOYSA-N
Molecular Weight 186.225 g/mol
SMILES OS(c1ccc(cc1)CC)(=O)=O
SPLASH splash10-0adl-7900000000-dd6a8acb2fd59bdf2a31
Source of Spectrum O-19-49-3
Wiley ID 1182358