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2-hexyl-3-(4-methoxycarbonylphenyl)cyclopent-3-ene-1,1-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 8n350zaEiAz
InChI InChI=1S/C23H30O6/c1-5-6-7-8-9-19-18(16-10-12-17(13-11-16)20(24)27-2)14-15-23(19,21(25)28-3)22(26)29-4/h10-14,19H,5-9,15H2,1-4H3
InChIKey NHGSTDFTTCTSIO-UHFFFAOYSA-N
Mol Weight 402.49 g/mol
Molecular Formula C23H30O6
Exact Mass 402.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lg1S0m5lQmL
Name 2-hexyl-3-(4-methoxycarbonylphenyl)cyclopent-3-ene-1,1-dicarboxylic acid dimethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C23H30O6
InChI InChI=1S/C23H30O6/c1-5-6-7-8-9-19-18(16-10-12-17(13-11-16)20(24)27-2)14-15-23(19,21(25)28-3)22(26)29-4/h10-14,19H,5-9,15H2,1-4H3
InChIKey NHGSTDFTTCTSIO-UHFFFAOYSA-N
Molecular Weight 402.487 g/mol
SMILES C1(C(C(c2ccc(C(=O)OC)cc2)=CC1)CCCCCC)(C(=O)OC)C(=O)OC
SPLASH splash10-0udi-0090300000-43f12eb45bbf0406e188
Source of Spectrum J-67-2845-3
Synonyms 3-(4-carbomethoxyphenyl)-2-hexyl-cyclopent-3-ene-1,1-dicarboxylic acid dimethyl ester dimethyl 2-hexyl-3-(4-methoxycarbonylphenyl)cyclopent-3-ene-1,1-dicarboxylate
Wiley ID 1569599