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tert-Butyl 2-benzyl-3-oxobutanoate
SpectraBase Compound ID 9jHPQzMYVE
InChI InChI=1S/C15H20O3/c1-11(16)13(14(17)18-15(2,3)4)10-12-8-6-5-7-9-12/h5-9,13H,10H2,1-4H3
InChIKey AYIKXYLCFDRJRR-UHFFFAOYSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNwd502jPt9
Name tert-Butyl 2-benzyl-3-oxobutanoate
Alternate Name(s) 3-Oxo-2-(phenylmethyl)butanoic acid tert-butyl ester tert-Butyl 2-benzyl-3-oxo-butanoate tert-Butyl 3-oxidanylidene-2-(phenylmethyl)butanoate
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Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-11(16)13(14(17)18-15(2,3)4)10-12-8-6-5-7-9-12/h5-9,13H,10H2,1-4H3
InChIKey AYIKXYLCFDRJRR-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4cc01631a
Molecular Weight 248.322 g/mol
SMILES CC(C(Cc1ccccc1)C(OC(C)(C)C)=O)=O
SPLASH splash10-0007-7900000000-72cce6cb696bb90b82ff
Source of Spectrum KD-50-7870/SMS17-4p
Wiley ID 1754615