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(E/Z)-diethyl 2-(but-2-ynyl)-2-(3-cyanoallyl)malonate
SpectraBase Compound ID 54zq19BrYjB
InChI InChI=1S/C15H19NO4/c1-4-7-10-15(11-8-9-12-16,13(17)19-5-2)14(18)20-6-3/h8-9H,5-6,10-11H2,1-3H3/b9-8+
InChIKey AXBKSPOITLDSQA-CMDGGOBGSA-N
Mol Weight 277.32 g/mol
Molecular Formula C15H19NO4
Exact Mass 277.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 29eu2m3aZfm
Name (E/Z)-diethyl 2-(but-2-ynyl)-2-(3-cyanoallyl)malonate
Alternate Name(s) (E)-diethyl 2-(but-2-yn-1-yl)-2-(3-cyanoallyl)malonate
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Formula C15H19NO4
InChI InChI=1S/C15H19NO4/c1-4-7-10-15(11-8-9-12-16,13(17)19-5-2)14(18)20-6-3/h8-9H,5-6,10-11H2,1-3H3/b9-8+
InChIKey AXBKSPOITLDSQA-CMDGGOBGSA-N
Literature Reference DOI 10.1002/adsc.201000772
Molecular Weight 277.320 g/mol
SMILES C(C(OCC)=O)(CC#CC)(C(OCC)=O)C\C=C\C#N
SPLASH splash10-0159-0920000000-640711465250af8e39b3
Source of Spectrum ASC-353-897/SM4-1ia
Wiley ID 1764823