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3-benzyl-7-nitroimidazo[4,5-g]cinnoline-8-aldehyde oxime
SpectraBase Compound ID SfdnYapMyK
InChI InChI=1S/C17H12N6O3/c24-18-10-22-16-9-14-12(8-15(16)19-17(22)23(25)26)7-13(20-21-14)6-11-4-2-1-3-5-11/h1-5,7-10,24H,6H2/b18-10+
InChIKey SCDQGUUVLSBVAA-VCHYOVAHSA-N
Mol Weight 348.32 g/mol
Molecular Formula C17H12N6O3
Exact Mass 348.097088 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EkSPckR0Q5t
Name 3-benzyl-7-nitroimidazo[4,5-g]cinnoline-8-aldehyde oxime
CAS Registry Number 96228-55-6
Comments Less than 3 mono-isotopic peaks
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Formula C17H12N6O3
InChI InChI=1S/C17H12N6O3/c24-18-10-22-16-9-14-12(8-15(16)19-17(22)23(25)26)7-13(20-21-14)6-11-4-2-1-3-5-11/h1-5,7-10,24H,6H2/b18-10+
InChIKey SCDQGUUVLSBVAA-VCHYOVAHSA-N
Molecular Weight 348.322 g/mol
SMILES O\N=C\[n]1c(nc2cc3cc(Cc4ccccc4)nnc3cc12)N(=O)=O
SPLASH splash10-0006-9003000000-0b4947ea93fe0853af57
Source of Spectrum J-50-2459-9
Synonyms 3-benzyl-7-nitro-8H-imidazo[4,5-g]cinnoline-8-carbaldehyde oxime
Wiley ID 1340429