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2-[(E)-2-phenylethenyl]propanedioic acid diethyl ester
SpectraBase Compound ID B3f7rYi2nL2
InChI InChI=1S/C15H18O4/c1-3-18-14(16)13(15(17)19-4-2)11-10-12-8-6-5-7-9-12/h5-11,13H,3-4H2,1-2H3/b11-10+
InChIKey SPHYRPRFMIACLW-ZHACJKMWSA-N
Mol Weight 262.3 g/mol
Molecular Formula C15H18O4
Exact Mass 262.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CHGuYTGIAQ0
Name 2-[(E)-2-phenylethenyl]propanedioic acid diethyl ester
Alternate Name(s) 2-[(E)-styryl]malonic acid diethyl ester diethyl 2-[(E)-2-phenylethenyl]malonate diethyl 2-[(E)-2-phenylethenyl]propanedioate diethyl 2-[(E)-styryl]propanedioate
Comments Less than 3 mono-isotopic peaks
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Formula C15H18O4
InChI InChI=1S/C15H18O4/c1-3-18-14(16)13(15(17)19-4-2)11-10-12-8-6-5-7-9-12/h5-11,13H,3-4H2,1-2H3/b11-10+
InChIKey SPHYRPRFMIACLW-ZHACJKMWSA-N
Molecular Weight 262.305 g/mol
SMILES C(C(C(=O)OCC)\C=C\c1ccccc1)(=O)OCC
SPLASH splash10-03di-0690000000-fe04eafba48a27a3b850
Source of Spectrum D1-2006-1722-0
Wiley ID 1614119