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2- and 4-Acetoxy-2-methyl-3-hexanone
SpectraBase Compound ID IqPIGG7EfjR
InChI InChI=1S/C9H16O3/c1-5-6-8(11)9(3,4)12-7(2)10/h5-6H2,1-4H3
InChIKey DAYBPEMFIMSPDK-UHFFFAOYSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4vMIQfavIbD
Name 2- and 4-Acetoxy-2-methyl-3-hexanone
Alternate Name(s) 1,1-Dimethyl-2-oxopentyl acetate
CAS Registry Number 69204-84-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-5-6-8(11)9(3,4)12-7(2)10/h5-6H2,1-4H3
InChIKey DAYBPEMFIMSPDK-UHFFFAOYSA-N
Molecular Weight 172.224 g/mol
SMILES C(OC(=O)C)(C(=O)CCC)(C)C
SPLASH splash10-0006-9100000000-80937fc099f4088a3dbd
Source of Spectrum J-44-1273-0
Wiley ID 1168692