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2,4-Dimethyl-1-penten-3-one
SpectraBase Compound ID FXcbhm5QZMy
InChI InChI=1S/C7H12O/c1-5(2)7(8)6(3)4/h6H,1H2,2-4H3
InChIKey UOJLCZCVCRDIHL-UHFFFAOYSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 48VhpluVwSp
Name 2,4-Dimethyl-1-penten-3-one
Alternate Name(s) 2,4-Dimethylpent-1-en-3-one 1-Penten-3-one, 2,4-dimethyl- Isopropyl isopropenyl ketone
CAS Registry Number 3212-68-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-5(2)7(8)6(3)4/h6H,1H2,2-4H3
InChIKey UOJLCZCVCRDIHL-UHFFFAOYSA-N
Molecular Weight 112.172 g/mol
SMILES C=C(C(C(C)C)=O)C
SPLASH splash10-00kf-9000000000-1186de693f92abb3a025
Source of Spectrum JX-2011-50
Wiley ID 1660255