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2-Cyclohexen-1-one, 2,4,4-trimethyl-3-(3-oxobutyl)-
SpectraBase Compound ID AlkPft4YqhO
InChI InChI=1S/C13H20O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h5-8H2,1-4H3
InChIKey QUHPCHDTFDSTTL-UHFFFAOYSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GQGsPSxSHu3
Name 2-Cyclohexen-1-one, 2,4,4-trimethyl-3-(3-oxobutyl)-
Alternate Name(s) 2,4,4-trimethyl-3-(3-oxidanylidenebutyl)cyclohex-2-en-1-one 2,4,4-Trimethyl-3-(3-oxobutyl)-2-cyclohexen-1-one 2,4,4-trimethyl-3-(3-oxobutyl)-1-cyclohex-2-enone 2,4,4-trimethyl-3-(3-oxobutyl)cyclohex-2-en-1-one 3-(3-ketobutyl)-2,4,4-trimethyl-cyclohex-2-en-1-one
CAS Registry Number 72008-46-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h5-8H2,1-4H3
InChIKey QUHPCHDTFDSTTL-UHFFFAOYSA-N
Molecular Weight 208.301 g/mol
SMILES C1CC(C)(C)C(=C(C1=O)C)CCC(C)=O
SPLASH splash10-0ap3-7910000000-1e15f0aefa44e8aaccf7
Source of Spectrum H-71-383-17
Wiley ID 1207235