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2-(3-NITROBENZENESULFONYLAMINO)-4,5,6,7-TETRAHYDRO-1,2-BENZISOTHIAZOL-3-(2H)-ONE-1,1-DIOXIDE
SpectraBase Compound ID HJLk4uc2PF9
InChI InChI=1S/C13H13N3O7S2/c17-13-11-6-1-2-7-12(11)25(22,23)15(13)14-24(20,21)10-5-3-4-9(8-10)16(18)19/h3-5,8,14H,1-2,6-7H2
InChIKey RSQLZPRCOGKONZ-UHFFFAOYSA-N
Mol Weight 387.38 g/mol
Molecular Formula C13H13N3O7S2
Exact Mass 387.019492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9e7DnihJrKE
Name 3-Nitro-N-(1,1,3-triketo-4,5,6,7-tetrahydro-1,2-benzothiazol-2-yl)benzenesulfonamide
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Formula C13H13N3O7S2
InChI InChI=1S/C13H13N3O7S2/c17-13-11-6-1-2-7-12(11)25(22,23)15(13)14-24(20,21)10-5-3-4-9(8-10)16(18)19/h3-5,8,14H,1-2,6-7H2
InChIKey RSQLZPRCOGKONZ-UHFFFAOYSA-N
Molecular Weight 387.381 g/mol
SMILES N(N1S(C=2CCCCC2C1=O)(=O)=O)S(c1cc(N(=O)=O)ccc1)(=O)=O
SPLASH splash10-001i-9500000000-09ccc1c16013b3dcd7a0
Source of Spectrum Y-36-1085-10
Synonyms 3-Nitro-N-(1,1,3-trioxo-4,5,6,7-tetrahydro-1,2-benzothiazol-2-yl)benzenesulfonamide 3-Nitro-N-[1,1,3-tris(oxidanylidene)-4,5,6,7-tetrahydro-1,2-benzothiazol-2-yl]benzenesulfonamide
Wiley ID 762574