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2-Butanone, 1-(benzoyloxy)-3,3-dimethyl-
SpectraBase Compound ID 6uipzZKvHAs
InChI InChI=1S/C13H16O3/c1-13(2,3)11(14)9-16-12(15)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
InChIKey WUWGYTYGOWIZED-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 DvrGF9WlyZC
Name 2-Butanone, 1-(benzoyloxy)-3,3-dimethyl-
Alternate Name(s) 1-(benzoyloxy)-3,3-dimethyl-2-butanone 1-Benzoyloxy-3,3-dimethylbutan-2-one 3,3-Dimethyl-2-oxobutyl benzoate
CAS Registry Number 76116-13-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-13(2,3)11(14)9-16-12(15)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
InChIKey WUWGYTYGOWIZED-UHFFFAOYSA-N
Molecular Weight 220.268 g/mol
SMILES C(OCC(C(C)(C)C)=O)(=O)c1ccccc1
SPLASH splash10-0a4i-5900000000-eac9298e80d2bb19571d
Source of Spectrum C-112-8877-12
Wiley ID 1219933