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E-Methyl 4-(Phenyl)-3-methoxycarbonylbut-3-enoate
SpectraBase Compound ID 8TxyZk4CD5N
InChI InChI=1S/C13H14O4/c1-16-12(14)9-11(13(15)17-2)8-10-6-4-3-5-7-10/h3-8H,9H2,1-2H3/b11-8+
InChIKey JEMWEPHOGQWJBS-DHZHZOJOSA-N
Mol Weight 234.25 g/mol
Molecular Formula C13H14O4
Exact Mass 234.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2W7X0wtBe0W
Name E-Methyl 4-(Phenyl)-3-methoxycarbonylbut-3-enoate
Alternate Name(s) (E)-Dimethyl 2-benzylidenesuccinate (2E)-2-(phenylmethylene)butanedioic acid dimethyl ester Dimethyl (2E)-2-benzylidenebutanedioate Dimethyl (2E)-2-(phenylmethylidene)butanedioate
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Formula C13H14O4
InChI InChI=1S/C13H14O4/c1-16-12(14)9-11(13(15)17-2)8-10-6-4-3-5-7-10/h3-8H,9H2,1-2H3/b11-8+
InChIKey JEMWEPHOGQWJBS-DHZHZOJOSA-N
Literature Reference DOI 10.1002/hc.10142
Molecular Weight 234.251 g/mol
SMILES C(C\C(C(=O)OC)=C/c1ccccc1)(=O)OC
SPLASH splash10-0gb9-1980000000-58eaf7c2600630d4fd41
Source of Spectrum HAC-14-278-E_6d
Wiley ID 1775891