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2-tert-Butyl-3-keto-4,4-dimethyl-valeric acid methyl ester
SpectraBase Compound ID 3mPXFP7gNIX
InChI InChI=1S/C12H22O3/c1-11(2,3)8(10(14)15-7)9(13)12(4,5)6/h8H,1-7H3
InChIKey UONVHWVNTRQCJQ-UHFFFAOYSA-N
Mol Weight 214.3 g/mol
Molecular Formula C12H22O3
Exact Mass 214.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KB7jQOPFM9r
Name 2-tert-Butyl-3-keto-4,4-dimethyl-valeric acid methyl ester
Alternate Name(s) 2-tert-Butyl-4,4-dimethyl-3-oxopentanoic acid methyl ester Methyl 2-tert-butyl-4,4-dimethyl-3-oxidanylidene-pentanoate Methyl 2-tert-butyl-4,4-dimethyl-3-oxo-pentanoate
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Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-11(2,3)8(10(14)15-7)9(13)12(4,5)6/h8H,1-7H3
InChIKey UONVHWVNTRQCJQ-UHFFFAOYSA-N
Molecular Weight 214.305 g/mol
SMILES C(C(C(C)(C)C)=O)(C(=O)OC)C(C)(C)C
SPLASH splash10-0zfr-1900000000-2364263a994bce480249
Source of Spectrum F-48-7651-1
Wiley ID 1213669