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THIOSACCHARIN;1,2-BENZISOTHIAZOL-3-(2H)-THIONE-1,1-DIOXIDE
SpectraBase Compound ID 5d3YFTdGYvw
InChI InChI=1S/C7H5NO2S2/c9-12(10)6-4-2-1-3-5(6)7(11)8-12/h1-4H,(H,8,11)
InChIKey BAVQVWLILLHJKA-UHFFFAOYSA-N
Mol Weight 199.24 g/mol
Molecular Formula C7H5NO2S2
Exact Mass 198.976171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9LLYotAZ7Lj
Name 1,2-Benzisothiazole-3(2H)-thione, 1,1-dioxide
CAS Registry Number 27148-03-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H5NO2S2
InChI InChI=1S/C7H5NO2S2/c9-12(10)6-4-2-1-3-5(6)7(11)8-12/h1-4H,(H,8,11)
InChIKey BAVQVWLILLHJKA-UHFFFAOYSA-N
Molecular Weight 199.242 g/mol
SMILES SC=1c2ccccc2S(N1)(=O)=O
SPLASH splash10-0f6t-7900000000-64867a4c964833d1cb47
Source of Spectrum O-2-1120-4
Synonyms 1,1-bis(oxidanylidene)-1,2-benzothiazole-3-thione 1,1-Diketo-1,2-benzothiazole-3-thione 1,1-Dioxo-1,2-benzothiazole-3-thione 1,2-benzisothiazole-3-thiol 1,1-dioxide 1,2-Benzisothiazoline-3-thione, 1,1-dioxide 3-Mercaptobenzisothiazole S,S-dioxide
Wiley ID 23152