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1H-Indole, 3-methyl-1-(methylsulfonyl)-
SpectraBase Compound ID 76kTcNIVdGO
InChI InChI=1S/C10H11NO2S/c1-8-7-11(14(2,12)13)10-6-4-3-5-9(8)10/h3-7H,1-2H3
InChIKey JNEQBSDHRVUYHH-UHFFFAOYSA-N
Mol Weight 209.26 g/mol
Molecular Formula C10H11NO2S
Exact Mass 209.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3dYgLaHd9U
Name 1H-Indole, 3-methyl-1-(methylsulfonyl)-
CAS Registry Number 108665-97-0
Comments Less than 3 mono-isotopic peaks
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Formula C10H11NO2S
InChI InChI=1S/C10H11NO2S/c1-8-7-11(14(2,12)13)10-6-4-3-5-9(8)10/h3-7H,1-2H3
InChIKey JNEQBSDHRVUYHH-UHFFFAOYSA-N
Molecular Weight 209.263 g/mol
SMILES CS([n]1cc(C)c2c1cccc2)(=O)=O
SPLASH splash10-001i-0930000000-6a63ae45648c67606a67
Source of Spectrum J-52-3408-4
Synonyms 1-mesyl-3-methyl-indole 3-methyl-1-(methylsulfonyl)-1H-indole 3-methyl-1-methylsulfonyl-indole
Wiley ID 1207951