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4-Acetyl-3,5,5-trimethyl-1-cyclohex-2-enone
SpectraBase Compound ID E55bDr9iuj
InChI InChI=1S/C11H16O2/c1-7-5-9(13)6-11(3,4)10(7)8(2)12/h5,10H,6H2,1-4H3
InChIKey CUBVKAWHVIABMV-UHFFFAOYSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GG7VpLosbTQ
Name 4-Acetyl-3,5,5-trimethyl-1-cyclohex-2-enone
Alternate Name(s) 4-Acetyl-3,5,5-trimethyl-cyclohex-2-en-1-one 4-Ethanoyl-3,5,5-trimethyl-cyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-7-5-9(13)6-11(3,4)10(7)8(2)12/h5,10H,6H2,1-4H3
InChIKey CUBVKAWHVIABMV-UHFFFAOYSA-N
Molecular Weight 180.247 g/mol
SMILES C=1(C(C(C)(C)CC(C1)=O)C(=O)C)C
SPLASH splash10-00di-2900000000-c074991dbc103d906b7b
Source of Spectrum J-63-9444-1
Wiley ID 1176667