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E-Methyl 4-(4-Chlorophenyl)-3-methoxycarbonylbut-3-enoate
SpectraBase Compound ID FWPVxe9L5QH
InChI InChI=1S/C13H13ClO4/c1-17-12(15)8-10(13(16)18-2)7-9-3-5-11(14)6-4-9/h3-7H,8H2,1-2H3/b10-7+
InChIKey QTBIZECTASBXKD-JXMROGBWSA-N
Mol Weight 268.7 g/mol
Molecular Formula C13H13ClO4
Exact Mass 268.050237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ITewUOOcKmn
Name E-Methyl 4-(4-Chlorophenyl)-3-methoxycarbonylbut-3-enoate
Alternate Name(s) (E)-Dimethyl 2-(4-chlorobenzylidene)succinate (2E)-2-[(4-chlorophenyl)methylidene]butanedioic acid dimethyl ester Dimethyl (2E)-2-[(4-chlorophenyl)methylene]butanedioate Dimethyl (2E)-2-[(4-chlorophenyl)methylidene]butanedioate
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Formula C13H13ClO4
InChI InChI=1S/C13H13ClO4/c1-17-12(15)8-10(13(16)18-2)7-9-3-5-11(14)6-4-9/h3-7H,8H2,1-2H3/b10-7+
InChIKey QTBIZECTASBXKD-JXMROGBWSA-N
Literature Reference DOI 10.1002/cjoc.201090064
Molecular Weight 268.696 g/mol
SMILES c1cc(ccc1Cl)\C=C\(C(=O)OC)CC(=O)OC
SPLASH splash10-014s-0890000000-aafca0512e992f60928e
Source of Spectrum CJC-28-265-3g
Wiley ID 1772395