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3-(2-methylsulfinylethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine
SpectraBase Compound ID Cb6IEDY7Dbe
InChI InChI=1S/C11H11F3N2O2S2/c1-20(17)5-4-16-8-3-2-7(18-11(12,13)14)6-9(8)19-10(16)15/h2-3,6,15H,4-5H2,1H3
InChIKey LRGODYPLNAVOAD-UHFFFAOYSA-N
Mol Weight 324.34 g/mol
Molecular Formula C11H11F3N2O2S2
Exact Mass 324.021404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6HM8swHI8Vd
Name 3-(2-methylsulfinylethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine
Alternate Name(s) 3-(2-methylsulfinylethyl)-6-(trifluoromethyloxy)-1,3-benzothiazol-2-imine [3-(2-methylsulfinylethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-2-ylidene]amine
Comments Less than 3 mono-isotopic peaks
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Formula C11H11F3N2O2S2
InChI InChI=1S/C11H11F3N2O2S2/c1-20(17)5-4-16-8-3-2-7(18-11(12,13)14)6-9(8)19-10(16)15/h2-3,6,15H,4-5H2,1H3
InChIKey LRGODYPLNAVOAD-UHFFFAOYSA-N
Molecular Weight 324.336 g/mol
SMILES N=C1Sc2c(N1CCS(=O)C)ccc(c2)OC(F)(F)F
SPLASH splash10-0a59-0090000000-e06d42746137601c1830
Source of Spectrum F2-42-2840-64
Wiley ID 1600297