(+)-Acorenone B
[CAS# 21653-33-8]

Identification

• Name: (+)-Acorenone B
• Synonyms: (1S,4S)-1-Isopropyl-4,8-Dimethyl-Spiro[4.5]Dec-8-En-7-One; (1S,4S)-1-Isopropyl-4,8-Dimethyl-7-Spiro[4.5]Dec-8-Enone; (1S,4S)-4,8-Dimethyl-1-Propan-2-Yl-Spiro[4.5]Dec-8-En-7-One
• Molecular Formula: C₁₅H₂₄O
• Molecular Weight: 220.35
• CAS Registry Number: 21653-33-8
• SMILES: [C@@H]1(C2([C@H](CC1)C)CC(=O)C(=CC2)C)C(C)C
• InChI: 1S/C15H24O/c1-10(2)13-6-5-12(4)15(13)8-7-11(3)14(16)9-15/h7,10,12-13H,5-6,8-9H2,1-4H3/t12-,13-,15?/m0/s1
• InChIKey: HBTHUBMUAHAWBC-QNIGDANOSA-N

Properties

• Density: 0.954g/cm³ (Cal.)
• Boiling point: 317.733°C at 760 mmHg (Cal.)
• Flash point: 139.494°C (Cal.)