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3,3-dimethyl-2,3-dihydro-1,2-benzisothiazole 1,1-dioxide
SpectraBase Compound ID 7MbIlT0EM7H
InChI InChI=1S/C9H11NO2S/c1-9(2)7-5-3-4-6-8(7)13(11,12)10-9/h3-6,10H,1-2H3
InChIKey XHTPPQBDONGRAF-UHFFFAOYSA-N
Mol Weight 197.25 g/mol
Molecular Formula C9H11NO2S
Exact Mass 197.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D23IUNnXzPG
Name 3,3-dimethyl-2,3-dihydro-1,2-benzisothiazole 1,1-dioxide
Comments Less than 3 mono-isotopic peaks
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Formula C9H11NO2S
InChI InChI=1S/C9H11NO2S/c1-9(2)7-5-3-4-6-8(7)13(11,12)10-9/h3-6,10H,1-2H3
InChIKey XHTPPQBDONGRAF-UHFFFAOYSA-N
Molecular Weight 197.252 g/mol
SMILES N1C(c2c(S1(=O)=O)cccc2)(C)C
SPLASH splash10-001i-0900000000-f1bcf3cbf4db59cf1825
Source of Spectrum SO-0-1231-1
Synonyms 3,3-dimethyl-2H-1,2-benzothiazole 1,1-dioxide
Wiley ID 863919