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3-{[(5-Bromopyridinium-2-yl)amino]carbonyl}-1-methyl-2,2-dioxo-1H-2.lamda.(6),1-benzothiazin-4-olate
SpectraBase Compound ID 4d7uF10ZgCb
InChI InChI=1S/C15H12BrN3O4S/c1-19-11-5-3-2-4-10(11)13(20)14(24(19,22)23)15(21)18-12-7-6-9(16)8-17-12/h2-8,20H,1H3,(H,17,18,21)
InChIKey XMZTUFOTVJAPSF-UHFFFAOYSA-N
Mol Weight 410.24 g/mol
Molecular Formula C15H12BrN3O4S
Exact Mass 408.97319 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BFIPY6CdLy
Name 3-{[(5-Bromopyridinium-2-yl)amino]carbonyl}-1-methyl-2,2-dioxo-1H-2.lamda.(6),1-benzothiazin-4-olate
Alternate Name(s) 4-Hydroxy-1-methyl-2,2-dioxo-1,2-dihydro-2lambda*6*-benzo[c][1,2]thiazine-3-carboxylic acid (5-bromo-pyridin-2-yl)-amide N-(5-bromopyridin-2-yl)-4-hydroxy-1-methyl-1H-benzo[c][1,2]thiazine-3-carboxamide 2,2-dioxide
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Formula C15H12BrN3O4S
InChI InChI=1S/C15H12BrN3O4S/c1-19-11-5-3-2-4-10(11)13(20)14(24(19,22)23)15(21)18-12-7-6-9(16)8-17-12/h2-8,20H,1H3,(H,17,18,21)
InChIKey XMZTUFOTVJAPSF-UHFFFAOYSA-N
Molecular Weight 410.242 g/mol
SMILES OC=1c2ccccc2N(S(C1C(Nc1ncc(cc1)Br)=O)(=O)=O)C
SPLASH splash10-006t-1901000000-3724373bb15f230cb484
Source of Spectrum HC-50-571-3h
Wiley ID 1739696