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Bis(2-isopropyl-5-methylcyclohexyl) 2-tert-butylmalonate
SpectraBase Compound ID 882qHkrqOi7
InChI InChI=1S/C27H48O4/c1-16(2)20-12-10-18(5)14-22(20)30-25(28)24(27(7,8)9)26(29)31-23-15-19(6)11-13-21(23)17(3)4/h16-24H,10-15H2,1-9H3
InChIKey CQBWETIHKIHMEY-UHFFFAOYSA-N
Mol Weight 436.7 g/mol
Molecular Formula C27H48O4
Exact Mass 436.35526 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3CCHDvbVxo
Name Bis(2-isopropyl-5-methylcyclohexyl) 2-tert-butylmalonate
Alternate Name(s) 2-tert-Butylmalonic acid bis(2-isopropyl-5-methyl-cyclohexyl) ester 2-tert-Butylpropanedioic acid bis(5-methyl-2-propan-2-ylcyclohexyl) ester bis(2-isopropyl-5-methyl-cyclohexyl) 2-tert-butylpropanedioate bis(5-methyl-2-propan-2-yl-cyclohexyl) 2-tert-butylpropanedioate Malonic acid, t-butyl-, di-(-)-menthyl ester
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Formula C27H48O4
InChI InChI=1S/C27H48O4/c1-16(2)20-12-10-18(5)14-22(20)30-25(28)24(27(7,8)9)26(29)31-23-15-19(6)11-13-21(23)17(3)4/h16-24H,10-15H2,1-9H3
InChIKey CQBWETIHKIHMEY-UHFFFAOYSA-N
Molecular Weight 436.677 g/mol
SMILES CC(C(C(OC1C(CCC(C)C1)C(C)C)=O)C(=O)OC1C(C(C)C)CCC(C)C1)(C)C
SPLASH splash10-0019-9700000000-b505255268758adc8b30
Wiley ID 1496439