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2,3-Dihydropyrrolo[1,2-b][1,2]benzoisothiazole-1-carboxylic acid 5,5-dioxide
SpectraBase Compound ID Ck8ZW6uTV67
InChI InChI=1S/C11H9NO4S/c13-11(14)8-5-6-12-10(8)7-3-1-2-4-9(7)17(12,15)16/h1-4H,5-6H2,(H,13,14)
InChIKey HXAREYFFIHRZGQ-UHFFFAOYSA-N
Mol Weight 251.26 g/mol
Molecular Formula C11H9NO4S
Exact Mass 251.025229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IiHWNyS8F0c
Name 2,3-Dihydropyrrolo[1,2-b][1,2]benzoisothiazole-1-carboxylic acid 5,5-dioxide
Alternate Name(s) 2,3-Dihydropyrrolo[1,2-b][1,2]benzisothiazole-1-carboxylic acid 5,5-dioxide
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Formula C11H9NO4S
InChI InChI=1S/C11H9NO4S/c13-11(14)8-5-6-12-10(8)7-3-1-2-4-9(7)17(12,15)16/h1-4H,5-6H2,(H,13,14)
InChIKey HXAREYFFIHRZGQ-UHFFFAOYSA-N
Molecular Weight 251.256 g/mol
SMILES OC(C1=C2N(S(c3c2cccc3)(=O)=O)CC1)=O
SPLASH splash10-0udi-1790000000-bd74d95c72a6dc0dae3e
Source of Spectrum SO-0-1226-7
Wiley ID 863975