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2,1,3-Benzoxadiazole-5-carboxylic acid, 3-oxide
SpectraBase Compound ID LMKOZE5M6Fm
InChI InChI=1S/C7H4N2O4/c10-7(11)4-1-2-5-6(3-4)9(12)13-8-5/h1-3H,(H,10,11)
InChIKey BGFDDZZBXBIHJI-UHFFFAOYSA-N
Mol Weight 180.12 g/mol
Molecular Formula C7H4N2O4
Exact Mass 180.017107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GrwH5dmAU8G
Name 2,1,3-Benzoxadiazole-5-carboxylic acid, 3-oxide
Alternate Name(s) 3-Oxido-2,1,3-benzoxadiazol-3-ium-5-carboxylic acid 3-Oxidanidyl-2,1,3-benzoxadiazol-3-ium-5-carboxylic acid
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Formula C7H4N2O4
InChI InChI=1S/C7H4N2O4/c10-7(11)4-1-2-5-6(3-4)9(12)13-8-5/h1-3H,(H,10,11)
InChIKey BGFDDZZBXBIHJI-UHFFFAOYSA-N
Molecular Weight 180.119 g/mol
SMILES OC(=O)c1cc2c(cc1)no[n+]2[O-]
SPLASH splash10-0ugi-9200000000-9c109f0c833fe8ead3f8
Source of Spectrum IY-2-4850-9
Wiley ID 1656732