(2E)-1-[(1R)-2,6,6-Trimethyl-2-Cyclohexen-1-Yl]-2-Buten-1-One

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Properties Simple | Detailed

Formula C13H20O
IUPAC Name (e)-1-[(1r)-2,6,6-trimethylcyclohex-2-en-1-yl]but-2-en-1-one
Molecular Mass 192.297 g·mol−1
Heat of Formation -213.8 ± 16.7 kJ·mol−1
Dipole Moment 2.90 ± 1.08 D
Volume 271.69 Å 3
Surface Area 241.2 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy 0.07 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-1-[(1r)-2,6,6-trimethyl-1-cyclohex-2-enyl]but-2-en-1-one
InChIKey CRIGTVCBMUKRSL-HOSRBBHYSA-N
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Elements H C O