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2-Methyl-2-[(E)-3-phenylprop-2-enyl]propanedioic acid dimethyl ester
SpectraBase Compound ID H3Key7NgmJE
InChI InChI=1S/C15H18O4/c1-15(13(16)18-2,14(17)19-3)11-7-10-12-8-5-4-6-9-12/h4-10H,11H2,1-3H3/b10-7+
InChIKey MWVNJPXCTNQVBS-JXMROGBWSA-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 I6KEhtzPzYw
Name 2-Methyl-2-[(E)-3-phenylprop-2-enyl]propanedioic acid dimethyl ester
Alternate Name(s) 2-[(E)-cinnamyl]-2-methyl-malonic acid dimethyl ester Dimethyl 2-methyl-2-[(E)-3-phenylprop-2-enyl]propanedioate Dimethyl 2-[(E)-cinnamyl]-2-methyl-propanedioate
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Formula C15H18O4
InChI InChI=1S/C15H18O4/c1-15(13(16)18-2,14(17)19-3)11-7-10-12-8-5-4-6-9-12/h4-10H,11H2,1-3H3/b10-7+
InChIKey MWVNJPXCTNQVBS-JXMROGBWSA-N
Molecular Weight 262.305 g/mol
SMILES C(C(=O)OC)(C(=O)OC)(C\C=C\c1ccccc1)C
SPLASH splash10-00kf-1900000000-21fb86d1bc57a3011e25
Source of Spectrum J-64-2965-3
Wiley ID 1530040