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1-Cyclopentene-1-carboxylic acid, 2,4,4-tris(3-methylbutyl)-3,5-dioxo-, ethyl ester
SpectraBase Compound ID 3asT25XRi0d
InChI InChI=1S/C23H38O4/c1-8-27-22(26)19-18(10-9-15(2)3)20(24)23(21(19)25,13-11-16(4)5)14-12-17(6)7/h15-17H,8-14H2,1-7H3
InChIKey VRQWMOMCPOHFJX-UHFFFAOYSA-N
Mol Weight 378.6 g/mol
Molecular Formula C23H38O4
Exact Mass 378.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jnsRSmDBvP
Name 1-Cyclopentene-1-carboxylic acid, 2,4,4-tris(3-methylbutyl)-3,5-dioxo-, ethyl ester
CAS Registry Number 63832-12-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H38O4
InChI InChI=1S/C23H38O4/c1-8-27-22(26)19-18(10-9-15(2)3)20(24)23(21(19)25,13-11-16(4)5)14-12-17(6)7/h15-17H,8-14H2,1-7H3
InChIKey VRQWMOMCPOHFJX-UHFFFAOYSA-N
Molecular Weight 378.553 g/mol
SMILES C1(=C(C(=O)C(C1=O)(CCC(C)C)CCC(C)C)CCC(C)C)C(=O)OCC
SPLASH splash10-03e9-0095000000-b8118cb9bbd700a18523
Source of Spectrum F-33-425-0
Synonyms 2-Ethoxycarbonyl-3,5,5-tri)3-methylbutyl)cyclopenten-1,4-dione Ethyl 2,4,4-triisopentyl-3,5-dioxo-1-cyclopentene-1-carboxylate
Wiley ID 1358967