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2-Pentanone, 3-[(acetyloxy)methyl]-3,4-dimethyl-, (.+-.)-
SpectraBase Compound ID 3kRq4AnU85B
InChI InChI=1S/C10H18O3/c1-7(2)10(5,8(3)11)6-13-9(4)12/h7H,6H2,1-5H3
InChIKey QQUJNKNHYBAKEJ-UHFFFAOYSA-N
Mol Weight 186.25 g/mol
Molecular Formula C10H18O3
Exact Mass 186.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID qGEb1JIMAb
Name 2-Pentanone, 3-[(acetyloxy)methyl]-3,4-dimethyl-, (.+-.)-
Alternate Name(s) 2-Acetyl-2,3-dimethylbutyl acetate (2-ethanoyl-2,3-dimethyl-butyl) ethanoate Acetic acid (2-acetyl-2,3-dimethyl-butyl) ester Acetic acid (2-acetyl-2,3-dimethylbutyl) ester (2-acetyl-2,3-dimethylbutyl) acetate
CAS Registry Number 78641-04-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O3
InChI InChI=1S/C10H18O3/c1-7(2)10(5,8(3)11)6-13-9(4)12/h7H,6H2,1-5H3
InChIKey QQUJNKNHYBAKEJ-UHFFFAOYSA-N
Molecular Weight 186.251 g/mol
SMILES CC(C)C(C)(C(=O)C)COC(=O)C
SPLASH splash10-00l6-9000000000-bbbfc3f9fa003606caa2
Wiley ID 1488512