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Benzo[b]thiophene-5-carboxylic acid, 1,1-dioxide
SpectraBase Compound ID CHxSwouOk1F
InChI InChI=1S/C9H6O4S/c10-9(11)7-1-2-8-6(5-7)3-4-14(8,12)13/h1-5H,(H,10,11)
InChIKey KJBAZFOFYZODKB-UHFFFAOYSA-N
Mol Weight 210.2 g/mol
Molecular Formula C9H6O4S
Exact Mass 209.99868 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D89SyFyAfVw
Name Benzo[b]thiophene-5-carboxylic acid, 1,1-dioxide
Alternate Name(s) Benzo[b]thiophene-5-carboxylic acid 1,1-dioxide 1-Benzothiophene-5-carboxylic acid 1,1-dioxide 1,1-Dioxo-1-benzothiophene-5-carboxylic acid 1,1-Dioxobenzothiophene-5-carboxylic acid 1,1-Bis(oxidanylidene)-1-benzothiophene-5-carboxylic acid
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Formula C9H6O4S
InChI InChI=1S/C9H6O4S/c10-9(11)7-1-2-8-6(5-7)3-4-14(8,12)13/h1-5H,(H,10,11)
InChIKey KJBAZFOFYZODKB-UHFFFAOYSA-N
Molecular Weight 210.203 g/mol
SMILES OC(=O)c1ccc2c(C=CS2(=O)=O)c1
SPLASH splash10-001i-6910000000-64348518159fff18144a
Source of Spectrum JX-2015-0-11
Wiley ID 1720009