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5(6)-(Hydroxymethyl)benzo[1,2-c]-1,2,5-oxadiazole N1-Oxide
SpectraBase Compound ID 54l36xQuLVk
InChI InChI=1S/C7H6N2O3/c10-4-5-1-2-7-6(3-5)8-12-9(7)11/h1-3,10H,4H2
InChIKey PGGQDQFDAHJMTE-UHFFFAOYSA-N
Mol Weight 166.14 g/mol
Molecular Formula C7H6N2O3
Exact Mass 166.037842 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K2trwWtGwzO
Name 5(6)-(Hydroxymethyl)benzo[1,2-c]-1,2,5-oxadiazole N1-Oxide
Comments Less than 3 mono-isotopic peaks
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Formula C7H6N2O3
InChI InChI=1S/C7H6N2O3/c10-4-5-1-2-7-6(3-5)8-12-9(7)11/h1-3,10H,4H2
InChIKey PGGQDQFDAHJMTE-UHFFFAOYSA-N
Molecular Weight 166.136 g/mol
SMILES OCc1ccc2[n+](onc2c1)[O-]
SPLASH splash10-014i-0900000000-30ee18fc8295fecf62db
Source of Spectrum F2-42-1948-18
Synonyms (1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)methanol (1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-yl)methanol
Wiley ID 1600181