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2-[(2-phenyl-1H-imidazol-5-yl)methylene]malonic acid diethyl ester
SpectraBase Compound ID 8pPKINIk3a9
InChI InChI=1S/C17H18N2O4/c1-3-22-16(20)14(17(21)23-4-2)10-13-11-18-15(19-13)12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3,(H,18,19)
InChIKey UXLFVFVRUWXJQP-UHFFFAOYSA-N
Mol Weight 314.34 g/mol
Molecular Formula C17H18N2O4
Exact Mass 314.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGnwoXlEOHB
Name 2-[(2-phenyl-1H-imidazol-5-yl)methylene]malonic acid diethyl ester
Alternate Name(s) 2-[(2-phenyl-1H-imidazol-5-yl)methylidene]propanedioic acid diethyl ester Diethyl 2-[(2-phenyl-1H-imidazol-5-yl)methylene]propanedioate Diethyl 2-[(2-phenyl-1H-imidazol-5-yl)methylidene]propanedioate
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Formula C17H18N2O4
InChI InChI=1S/C17H18N2O4/c1-3-22-16(20)14(17(21)23-4-2)10-13-11-18-15(19-13)12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3,(H,18,19)
InChIKey UXLFVFVRUWXJQP-UHFFFAOYSA-N
Molecular Weight 314.341 g/mol
SMILES [nH]1c(nc(c1)C=C(C(=O)OCC)C(=O)OCC)-c1ccccc1
SPLASH splash10-0301-0896000000-45edbacdaa5f7dc2f7e9
Source of Spectrum AJ-43-1587-2
Wiley ID 1594360