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ethanone, 1-(4-amino-2-oxido-1,2,5-oxadiazol-3-yl)-2-(1H-benzimidazol-2-ylthio)-
SpectraBase Compound ID KLRXLsz2h08
InChI InChI=1S/C11H9N5O3S/c12-10-9(16(18)19-15-10)8(17)5-20-11-13-6-3-1-2-4-7(6)14-11/h1-4H,5H2,(H2,12,15)(H,13,14)
InChIKey LWWQCCJZTRMODK-UHFFFAOYSA-N
Mol Weight 291.28 g/mol
Molecular Formula C11H9N5O3S
Exact Mass 291.04261 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K4TVKPOnhLv
Name 1-(4-amino-2-oxido-1,2,5-oxadiazol-2-ium-3-yl)-2-(1H-benzimidazol-2-ylsulfanyl)ethanone
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Formula C11H9N5O3S
InChI InChI=1S/C11H9N5O3S/c12-10-9(16(18)19-15-10)8(17)5-20-11-13-6-3-1-2-4-7(6)14-11/h1-4H,5H2,(H2,12,15)(H,13,14)
InChIKey LWWQCCJZTRMODK-UHFFFAOYSA-N
Molecular Weight 291.285 g/mol
SMILES [nH]1c2ccccc2nc1SCC(c1c(no[n+]1[O-])N)=O
SPLASH splash10-0j4l-6920000000-0350faf814c334b3a998
Synonyms 1-(4-amino-2-oxido-1,2,5-oxadiazol-2-ium-3-yl)-2-(1H-benzimidazol-2-ylthio)ethanone 1-(4-amino-2-oxido-furazan-2-ium-3-yl)-2-(1H-benzimidazol-2-ylthio)ethanone 1-(4-azanyl-2-oxidanidyl-1,2,5-oxadiazol-2-ium-3-yl)-2-(1H-benzimidazol-2-ylsulfanyl)ethanone
Wiley ID 1511251