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Methyl 1-(2'-methylpropyl)-2-oxocyclododecanoate
SpectraBase Compound ID FQsUjJmws7v
InChI InChI=1S/C18H32O3/c1-15(2)14-18(17(20)21-3)13-11-9-7-5-4-6-8-10-12-16(18)19/h15H,4-14H2,1-3H3
InChIKey WMUYRJLAXFCWLL-UHFFFAOYSA-N
Mol Weight 296.5 g/mol
Molecular Formula C18H32O3
Exact Mass 296.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HYOC2pViyl2
Name Methyl 1-(2'-methylpropyl)-2-oxocyclododecanoate
Alternate Name(s) Methyl 1-isobutyl-2-oxocyclododecanecarboxylate 1-(2-Methylpropyl)-2-oxo-1-cyclododecanecarboxylic acid methyl ester Methyl 1-(2-methylpropyl)-2-oxocyclododecane-1-carboxylate Methyl 1-isobutyl-2-oxo-cyclododecanecarboxylate Methyl 1-(2-methylpropyl)-2-oxidanylidene-cyclododecane-1-carboxylate
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Formula C18H32O3
InChI InChI=1S/C18H32O3/c1-15(2)14-18(17(20)21-3)13-11-9-7-5-4-6-8-10-12-16(18)19/h15H,4-14H2,1-3H3
InChIKey WMUYRJLAXFCWLL-UHFFFAOYSA-N
Molecular Weight 296.451 g/mol
SMILES C1(C(=O)OC)(C(=O)CCCCCCCCCC1)CC(C)C
SPLASH splash10-0006-0090000000-a4c8cc75298cd80b93f1
Source of Spectrum F-48-4785-17
Wiley ID 1299424