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1,2-benzisothiazol-3(2H)-one, 4,6-diazido-2-methyl-, 1-oxide
SpectraBase Compound ID JSwQdp2MHAg
InChI InChI=1S/C8H5N7O2S/c1-15-8(16)7-5(12-14-10)2-4(11-13-9)3-6(7)18(15)17/h2-3H,1H3
InChIKey PKHODFLKUJJXQB-UHFFFAOYSA-N
Mol Weight 263.24 g/mol
Molecular Formula C8H5N7O2S
Exact Mass 263.022544 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6EthbMwC84F
Name 1,2-Benzisothiazol-3(2H)-one, 4,6-diazido-2-methyl-, 1-oxide
Comments Less than 3 mono-isotopic peaks
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Formula C8H5N7O2S
InChI InChI=1S/C8H5N7O2S/c1-15-8(16)7-5(12-14-10)2-4(11-13-9)3-6(7)18(15)17/h2-3H,1H3
InChIKey PKHODFLKUJJXQB-UHFFFAOYSA-N
Molecular Weight 263.235 g/mol
SMILES C1(N(S(c2c1c(cc(c2)N=[N+]=[N-])N=[N+]=[N-])=O)C)=O
SPLASH splash10-03di-0090000000-62e4636c8d0571a50cb0
Source of Spectrum H1-68-2496-44
Synonyms 4,6-diazido-1-keto-2-methyl-1,2-benzothiazol-3-one 4,6-diazido-2-methyl-1-oxidanylidene-1,2-benzothiazol-3-one 4,6-diazido-2-methyl-1-oxo-1,2-benzothiazol-3-one
Wiley ID 1593711