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2-(2-[(1,1-Dioxido-1,2-benzisothiazol-3-yl)amino]ethyl)-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID 7tnWTr6KcWo
InChI InChI=1S/C17H13N3O4S/c21-16-11-5-1-2-6-12(11)17(22)20(16)10-9-18-15-13-7-3-4-8-14(13)25(23,24)19-15/h1-8H,9-10H2,(H,18,19)
InChIKey AIALTSLVINIOME-UHFFFAOYSA-N
Mol Weight 355.37 g/mol
Molecular Formula C17H13N3O4S
Exact Mass 355.062677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3j7fpCS2HWs
Name 2-(2-[(1,1-Dioxido-1,2-benzisothiazol-3-yl)amino]ethyl)-1H-isoindole-1,3(2H)-dione
Alternate Name(s) 2-[2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]ethyl]isoindoline-1,3-quinone 2-[2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]ethyl]isoindole-1,3-dione 2-[2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]ethyl]isoindoline-1,3-dione 2-[2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]ethyl]isoindole-1,3-dione
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Formula C17H13N3O4S
InChI InChI=1S/C17H13N3O4S/c21-16-11-5-1-2-6-12(11)17(22)20(16)10-9-18-15-13-7-3-4-8-14(13)25(23,24)19-15/h1-8H,9-10H2,(H,18,19)
InChIKey AIALTSLVINIOME-UHFFFAOYSA-N
Molecular Weight 355.368 g/mol
SMILES N(C1=NS(c2c1cccc2)(=O)=O)CCN1C(c2ccccc2C1=O)=O
SPLASH splash10-0wb9-2900000000-478fa1b79d8df3270034
Wiley ID 1436998