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3-(4-Methoxyphenyl)pent-2-enedioic acid
SpectraBase Compound ID FksrSyMlkbw
InChI InChI=1S/C12H12O5/c1-17-10-4-2-8(3-5-10)9(6-11(13)14)7-12(15)16/h2-6H,7H2,1H3,(H,13,14)(H,15,16)/b9-6+
InChIKey MRBVUJRRYOZQGC-RMKNXTFCSA-N
Mol Weight 236.22 g/mol
Molecular Formula C12H12O5
Exact Mass 236.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHYOoqcn27
Name 3-(4-Methoxyphenyl)pent-2-enedioic acid
Alternate Name(s) (E)-3-(4-methoxyphenyl)pent-2-enedioic acid
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Formula C12H12O5
InChI InChI=1S/C12H12O5/c1-17-10-4-2-8(3-5-10)9(6-11(13)14)7-12(15)16/h2-6H,7H2,1H3,(H,13,14)(H,15,16)/b9-6+
InChIKey MRBVUJRRYOZQGC-RMKNXTFCSA-N
Literature Reference DOI 10.1002/prac.199633801139
Molecular Weight 236.223 g/mol
SMILES OC(C\C(=C/C(O)=O)c1ccc(cc1)OC)=O
SPLASH splash10-0f97-7900000000-a41515b0ca241ba999cd
Source of Spectrum JF-338-708-5
Wiley ID 1790003