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3-Methyl-4-[2-(2-methylphenyl)ethyl]cyclopent-2-ene-1,1-dicarboxylic acid diethyl ester
SpectraBase Compound ID ITLoWXqkVMa
InChI InChI=1S/C21H28O4/c1-5-24-19(22)21(20(23)25-6-2)13-16(4)18(14-21)12-11-17-10-8-7-9-15(17)3/h7-10,13,18H,5-6,11-12,14H2,1-4H3
InChIKey KUQDXINQDIPFDF-UHFFFAOYSA-N
Mol Weight 344.45 g/mol
Molecular Formula C21H28O4
Exact Mass 344.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CIgSTjrSsyd
Name 3-Methyl-4-[2-(2-methylphenyl)ethyl]cyclopent-2-ene-1,1-dicarboxylic acid diethyl ester
Alternate Name(s) 3-Methyl-4-[2-(o-tolyl)ethyl]cyclopent-2-ene-1,1-dicarboxylic acid diethyl ester Diethyl 3-methyl-4-[2-(2-methylphenyl)ethyl]cyclopent-2-ene-1,1-dicarboxylate Diethyl 3-methyl-4-[2-(o-tolyl)ethyl]cyclopent-2-ene-1,1-dicarboxylate
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Formula C21H28O4
InChI InChI=1S/C21H28O4/c1-5-24-19(22)21(20(23)25-6-2)13-16(4)18(14-21)12-11-17-10-8-7-9-15(17)3/h7-10,13,18H,5-6,11-12,14H2,1-4H3
InChIKey KUQDXINQDIPFDF-UHFFFAOYSA-N
Molecular Weight 344.451 g/mol
SMILES C1(C=C(C(C1)CCc1c(cccc1)C)C)(C(=O)OCC)C(=O)OCC
SPLASH splash10-0aor-1930000000-839e3f93e25726afcaf3
Source of Spectrum CV-2003-1178-3
Wiley ID 1611050