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5-Fluoro-4-nitro-1-methyl-2,1-benzisothiazoline 2,2-dioxide
SpectraBase Compound ID 21PA7zEIpUW
InChI InChI=1S/C8H7FN2O4S/c1-10-7-3-2-6(9)8(11(12)13)5(7)4-16(10,14)15/h2-3H,4H2,1H3
InChIKey LOPJUCAFUUHDHK-UHFFFAOYSA-N
Mol Weight 246.21 g/mol
Molecular Formula C8H7FN2O4S
Exact Mass 246.011056 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AADK11MakRw
Name 5-Fluoro-4-nitro-1-methyl-2,1-benzisothiazoline 2,2-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7FN2O4S
InChI InChI=1S/C8H7FN2O4S/c1-10-7-3-2-6(9)8(11(12)13)5(7)4-16(10,14)15/h2-3H,4H2,1H3
InChIKey LOPJUCAFUUHDHK-UHFFFAOYSA-N
Molecular Weight 246.212 g/mol
SMILES c12N(S(Cc1c(c(cc2)F)N(=O)=O)(=O)=O)C
SPLASH splash10-05nk-3930000000-9f5b56038ddd6f330273
Source of Spectrum O-28-853-0
Synonyms 5-Fluoro-1-methyl-4-nitro-1,3-dihydro-2,1-benzisothiazole 2,2-dioxide
Wiley ID 1248326