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2-(2,3,5,6-Tetrafluoro-4-pyridinyl)-1,2-benzisothiazol-3(2H)-one 1,1-dioxide
SpectraBase Compound ID FYmWXGi4hpY
InChI InChI=1S/C12H4F4N2O3S/c13-7-9(8(14)11(16)17-10(7)15)18-12(19)5-3-1-2-4-6(5)22(18,20)21/h1-4H
InChIKey CCGODDKNKIRBST-UHFFFAOYSA-N
Mol Weight 332.23 g/mol
Molecular Formula C12H4F4N2O3S
Exact Mass 331.987876 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HdOtCDrzARv
Name 2-(2,3,5,6-Tetrafluoro-4-pyridinyl)-1,2-benzisothiazol-3(2H)-one 1,1-dioxide
CAS Registry Number 71612-08-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H4F4N2O3S
InChI InChI=1S/C12H4F4N2O3S/c13-7-9(8(14)11(16)17-10(7)15)18-12(19)5-3-1-2-4-6(5)22(18,20)21/h1-4H
InChIKey CCGODDKNKIRBST-UHFFFAOYSA-N
Molecular Weight 332.229 g/mol
SMILES c1ccc2c(S(N(c3c(c(F)nc(c3F)F)F)C2=O)(=O)=O)c1
SPLASH splash10-0ugi-9222000000-604018be5b0274babb79
Source of Spectrum AD-0-2532-0
Synonyms 1,1-bis(oxidanylidene)-2-[2,3,5,6-tetrakis(fluoranyl)pyridin-4-yl]-1,2-benzothiazol-3-one 1,1-Diketo-2-(2,3,5,6-tetrafluoro-4-pyridyl)-1,2-benzothiazol-3-one 1,1-Dioxo-2-(2,3,5,6-tetrafluoro-4-pyridinyl)-1,2-benzothiazol-3-one 1,1-Dioxo-2-(2,3,5,6-tetrafluoro-4-pyridyl)-1,2-benzothiazol-3-one 1,1-Dioxo-2-(2,3,5,6-tetrafluoropyridin-4-yl)-1,2-benzothiazol-3-one Benzisothiazol-3(2H)-one, 2-(2,3,5,6-tetrafluoro-4-pyridyl)-, 1,1-dioxide
Wiley ID 1430703