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(E)-1-(Pyridin-3-ylmethyl)-2-[(cyano)(ethoxycarbonyl)methylidene]-3H-imidazoline
SpectraBase Compound ID B7HNR9YbHzy
InChI InChI=1S/C14H16N4O2/c1-2-20-14(19)12(8-15)13-17-6-7-18(13)10-11-4-3-5-16-9-11/h3-5,9,17H,2,6-7,10H2,1H3/b13-12+
InChIKey WMSOBJURNLVIKT-OUKQBFOZSA-N
Mol Weight 272.31 g/mol
Molecular Formula C14H16N4O2
Exact Mass 272.127326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DRc8YZsLR0S
Name (E)-1-(Pyridin-3-ylmethyl)-2-[(cyano)(ethoxycarbonyl)methylidene]-3H-imidazoline
Alternate Name(s) (2E)-2-cyano-2-[1-(3-pyridinylmethyl)-2-imidazolidinylidene]acetic acid ethyl ester Ethyl (2E)-2-cyano-2-[1-(pyridin-3-ylmethyl)imidazolidin-2-ylidene]acetate Ethyl (2E)-2-cyano-2-[1-(3-pyridylmethyl)imidazolidin-2-ylidene]acetate Ethyl (2E)-2-cyano-2-[1-(pyridin-3-ylmethyl)imidazolidin-2-ylidene]ethanoate
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Formula C14H16N4O2
InChI InChI=1S/C14H16N4O2/c1-2-20-14(19)12(8-15)13-17-6-7-18(13)10-11-4-3-5-16-9-11/h3-5,9,17H,2,6-7,10H2,1H3/b13-12+
InChIKey WMSOBJURNLVIKT-OUKQBFOZSA-N
Molecular Weight 272.308 g/mol
SMILES N1CCN(\C1=C/(C(=O)OCC)C#N)Cc1cnccc1
SPLASH splash10-05fv-6980000000-e7fb381a2cbe5dd3278a
Source of Spectrum Y-45-1048-3a
Wiley ID 1666288