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6-Nitro-1-oxo-1,2-dihydro-benzo[d]isothiazol-3-one
SpectraBase Compound ID 6ArgbA5dB7H
InChI InChI=1S/C7H4N2O4S/c10-7-5-2-1-4(9(11)12)3-6(5)14(13)8-7/h1-3H,(H,8,10)
InChIKey UNUPZDHGBOSWPV-UHFFFAOYSA-N
Mol Weight 212.18 g/mol
Molecular Formula C7H4N2O4S
Exact Mass 211.989178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LVfSjNwvEcp
Name 6-Nitro-1-oxo-1,2-dihydro-benzo[d]isothiazol-3-one
Alternate Name(s) 1-keto-6-nitro-1,2-benzothiazol-3-one 6-Nitro-1,2-benzisothiazol-3(2H)-one 1-oxide 6-Nitro-1-oxidanylidene-1,2-benzothiazol-3-one 6-Nitro-1-oxo-1,2-benzothiazol-3-one
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Formula C7H4N2O4S
InChI InChI=1S/C7H4N2O4S/c10-7-5-2-1-4(9(11)12)3-6(5)14(13)8-7/h1-3H,(H,8,10)
InChIKey UNUPZDHGBOSWPV-UHFFFAOYSA-N
Molecular Weight 212.179 g/mol
SMILES N1C(c2c(S1=O)cc(cc2)N(=O)=O)=O
SPLASH splash10-0fvi-4920000000-42924801b184fe01bf49
Source of Spectrum SO-0-1663-5
Wiley ID 878633