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2-[4,4-Dimethyl-2-(4-methylphenyl)methyl-2-cyclopenten-1-yl]propanedioic acid diethyl ester
SpectraBase Compound ID B3aAJKR2G8q
InChI InChI=1S/C22H30O4/c1-6-25-20(23)19(21(24)26-7-2)18-14-22(4,5)13-17(18)12-16-10-8-15(3)9-11-16/h8-11,13,18-19H,6-7,12,14H2,1-5H3
InChIKey DUJAWOUUIRLRCC-UHFFFAOYSA-N
Mol Weight 358.48 g/mol
Molecular Formula C22H30O4
Exact Mass 358.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ku5Hihg46Ma
Name 2-[4,4-Dimethyl-2-(4-methylphenyl)methyl-2-cyclopenten-1-yl]propanedioic acid diethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O4
InChI InChI=1S/C22H30O4/c1-6-25-20(23)19(21(24)26-7-2)18-14-22(4,5)13-17(18)12-16-10-8-15(3)9-11-16/h8-11,13,18-19H,6-7,12,14H2,1-5H3
InChIKey DUJAWOUUIRLRCC-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol800509z
Molecular Weight 358.478 g/mol
SMILES C1(C=C(Cc2ccc(cc2)C)C(C(C(=O)OCC)C(OCC)=O)C1)(C)C
SPLASH splash10-0bt9-0963000000-cc06e3168d50e44cd6e6
Source of Spectrum A1-10-2633/SMS20-23
Synonyms Diethyl 2-(4,4-dimethyl-2-(4-methylbenzyl)cyclopent-2-en-1-yl)malonate
Wiley ID 1759382