Ketone, propenyl 2,4,4-trimethyl-2-cyclohexen-1-yl

33673-71-1

CAS Name

1-(2,4,4-Trimethyl-2-cyclohexen-1-yl)-2-buten-1-one

Molecular Formula

C₁₃H₂₀O

Molecular Mass

192.30

Compound Properties

• Boiling Point (1)

  104-106 °C @ Press: 3 Torr

Source(s)

• (1) Rangnekar, Dinesh W.; Synthetic Communications, (2007), 37(3), 425-430, CAplus

Other Names and Identifiers

InChI

InChI=1S/C13H20O/c1-5-6-12(14)11-7-8-13(3,4)9-10(11)2/h5-6,9,11H,7-8H2,1-4H3

InChIKey

InChIKey=NELDPSDYTZADSA-UHFFFAOYSA-N

SMILES

C(C=CC)(=O)C1C(C)=CC(C)(C)CC1

Canonical SMILES

O=C(C=CC)C1C(=CC(C)(C)CC1)C

Other Names for this Substance