[1alpha(E),2beta]-1-(2,6,6-Trimethylcyclohex-3-En-1-Yl)But-2-En-1-One
[CAS# 71048-82-3]

Identification

• Name: [1alpha(E),2beta]-1-(2,6,6-Trimethylcyclohex-3-En-1-Yl)But-2-En-1-One
• Synonyms: 8-Damascone; Brn 1939321; Damascone, Delta-
• Molecular Formula: C₁₃H₂₀O
• Molecular Weight: 192.30
• CAS Registry Number: 71048-82-3 (41436-42-4;57378-68-4)
• EINECS: 275-156-8
• SMILES: CC1(C(C(C=CC1)C)C(\C=C\C)=O)C
• InChI: 1S/C13H20O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5-8,10,12H,9H2,1-4H3/b7-5+
• InChIKey: XEJGJTYRUWUFFD-FNORWQNLSA-N

Properties

• Density: 0.89g/cm³ (Cal.)
• Boiling point: 263.591°C at 760 mmHg (Cal.)
• Flash point: 103.704°C (Cal.)