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4,4-Dimethyl-2-cyclohexen-1-one
SpectraBase Compound ID 7R76SzJdGuR
InChI InChI=1S/C8H12O/c1-8(2)5-3-7(9)4-6-8/h3,5H,4,6H2,1-2H3
InChIKey HAUNPYVLVAIUOO-UHFFFAOYSA-N
Mol Weight 124.18 g/mol
Molecular Formula C8H12O
Exact Mass 124.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HVv433bYSE7
Name 2-Cyclohexen-1-one, 4,4-dimethyl-
CAS Registry Number 1073-13-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O
InChI InChI=1S/C8H12O/c1-8(2)5-3-7(9)4-6-8/h3,5H,4,6H2,1-2H3
InChIKey HAUNPYVLVAIUOO-UHFFFAOYSA-N
Molecular Weight 124.183 g/mol
SMILES C1=CC(=O)CCC1(C)C
SPLASH splash10-001i-9100000000-0721c10d568b032f3ddc
Source of Spectrum U1-2002-1713-13
Synonyms 4,4-Dimethyl-1-cyclohex-2-enone 4,4-Dimethyl-2-cyclohexen-1-one 4,4-Dimethyl-2-cyclohexenone 4,4-Dimethyl-cyclohex-2-enone 4,4-Dimethylcyclohex-2-en-1-one 4,4-Dimethylcyclohexenone
Wiley ID 1522462