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Tert-Butyl-2-oxo-2-(4-tolyl)acetate
SpectraBase Compound ID 3yKC2TGYvK6
InChI InChI=1S/C13H16O3/c1-9-5-7-10(8-6-9)11(14)12(15)16-13(2,3)4/h5-8H,1-4H3
InChIKey RCHORAQKKWBVBL-UHFFFAOYSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3CIr51K1qam
Name Tert-Butyl-2-oxo-2-(4-tolyl)acetate
Alternate Name(s) tert-Butyl 2-oxo-2-(p-tolyl)acetate 2-(4-Methylphenyl)-2-oxoacetic acid tert-butyl ester tert-Butyl 2-(4-methylphenyl)-2-oxoacetate tert-Butyl 2-(4-methylphenyl)-2-oxidanylidene-ethanoate
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Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-9-5-7-10(8-6-9)11(14)12(15)16-13(2,3)4/h5-8H,1-4H3
InChIKey RCHORAQKKWBVBL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201300352
Molecular Weight 220.268 g/mol
SMILES c1cc(C(C(=O)OC(C)(C)C)=O)ccc1C
SPLASH splash10-066r-9800000000-3e1f0aadb20f6b93fc76
Source of Spectrum ASC-355-1937/SM4-i
Wiley ID 1761620