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2-keto-1-(3-ketopropyl)-4,4-dimethyl-cyclohexanecarboxylic acid methyl ester
SpectraBase Compound ID GF8eTTQFh2D
InChI InChI=1S/C13H20O4/c1-12(2)6-7-13(5-4-8-14,10(15)9-12)11(16)17-3/h8H,4-7,9H2,1-3H3
InChIKey HZSIRSKTUMOHSS-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J4Ge1zCh3km
Name 2-keto-1-(3-ketopropyl)-4,4-dimethyl-cyclohexanecarboxylic acid methyl ester
Alternate Name(s) 4,4-Dimethyl-2-oxo-1-(3-oxopropyl)-1-cyclohexanecarboxylic acid methyl ester Methyl 4,4-dimethyl-2-oxidanylidene-1-(3-oxidanylidenepropyl)cyclohexane-1-carboxylate Methyl 4,4-dimethyl-2-oxo-1-(3-oxopropyl)cyclohexane-1-carboxylate Methyl 4,4-dimethyl-2-oxo-1-(3-oxopropyl)cyclohexanecarboxylate
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Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-12(2)6-7-13(5-4-8-14,10(15)9-12)11(16)17-3/h8H,4-7,9H2,1-3H3
InChIKey HZSIRSKTUMOHSS-UHFFFAOYSA-N
Molecular Weight 240.299 g/mol
SMILES C1(C(CC(CC1)(C)C)=O)(C(=O)OC)CCC=O
SPLASH splash10-001i-0900000000-05d381d57c86980d2c1a
Source of Spectrum F-48-4462-8
Wiley ID 1242914