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1-Cyclopentene-1-carboxylic acid, 2,4,4-tris(3-methylbutyl)-3,5-dioxo-, 1,1-dimethylethyl ester
SpectraBase Compound ID 4q24eJag315
InChI InChI=1S/C25H42O4/c1-16(2)10-11-19-20(23(28)29-24(7,8)9)22(27)25(21(19)26,14-12-17(3)4)15-13-18(5)6/h16-18H,10-15H2,1-9H3
InChIKey YOWLMALIUVCOQK-UHFFFAOYSA-N
Mol Weight 406.6 g/mol
Molecular Formula C25H42O4
Exact Mass 406.30831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CwjwWk3CAH6
Name 1-Cyclopentene-1-carboxylic acid, 2,4,4-tris(3-methylbutyl)-3,5-dioxo-, 1,1-dimethylethyl ester
CAS Registry Number 63832-14-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H42O4
InChI InChI=1S/C25H42O4/c1-16(2)10-11-19-20(23(28)29-24(7,8)9)22(27)25(21(19)26,14-12-17(3)4)15-13-18(5)6/h16-18H,10-15H2,1-9H3
InChIKey YOWLMALIUVCOQK-UHFFFAOYSA-N
Molecular Weight 406.607 g/mol
SMILES C1(=C(C(=O)C(C1=O)(CCC(C)C)CCC(C)C)CCC(C)C)C(OC(C)(C)C)=O
SPLASH splash10-0006-0092000000-cf7dc7c7d8f8bd8f4991
Source of Spectrum F-33-425-0
Synonyms 2-(t-butoxycarbonyl)-3,5,5-tri(3-methylbutyl)-2-cyclopenten-1,4-dione tert-Butyl 2,4,4-triisopentyl-3,5-dioxo-1-cyclopentene-1-carboxylate
Wiley ID 1372348