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Cyclohexane-1,3-dione, 2-[[(1H-benzoimidazol-2-ylmethyl)amino]methylene]-5,5-dimethyl-
SpectraBase Compound ID L4m1H8SENSW
InChI InChI=1S/C17H19N3O2/c1-17(2)7-14(21)11(15(22)8-17)9-18-10-16-19-12-5-3-4-6-13(12)20-16/h3-6,9,18H,7-8,10H2,1-2H3,(H,19,20)
InChIKey OTVIWJCGIWOLLR-UHFFFAOYSA-N
Mol Weight 297.36 g/mol
Molecular Formula C17H19N3O2
Exact Mass 297.147727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1HO5RdTriS
Name 2-[(1H-benzimidazol-2-ylmethylamino)methylene]-5,5-dimethyl-cyclohexane-1,3-dione
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Formula C17H19N3O2
InChI InChI=1S/C17H19N3O2/c1-17(2)7-14(21)11(15(22)8-17)9-18-10-16-19-12-5-3-4-6-13(12)20-16/h3-6,9,18H,7-8,10H2,1-2H3,(H,19,20)
InChIKey OTVIWJCGIWOLLR-UHFFFAOYSA-N
Molecular Weight 297.358 g/mol
SMILES N(C=C1C(CC(C)(C)CC1=O)=O)Cc1[nH]c2c(n1)cccc2
SPLASH splash10-001i-6910000000-7e7126b02e35fe4a5126
Synonyms 2-[(1H-benzimidazol-2-ylmethylamino)methylene]-5,5-dimethyl-cyclohexane-1,3-quinone 2-[(1H-benzimidazol-2-ylmethylamino)methylidene]-5,5-dimethyl-cyclohexane-1,3-dione Cyclohexane-1,3-dione, 2-[[(1H-benzoimidazol-2-ylmethyl)amino]methylene]-5,5-dimethyl-
Wiley ID 1446216