4-(5,5-Dimethyl-3-Oxo-1-Cyclohexenyl)Benzonitrile
[CAS# 72036-56-7]

Identification

• Name: 4-(5,5-Dimethyl-3-Oxo-1-Cyclohexenyl)Benzonitrile
• Synonyms: 4-(3-Keto-5,5-Dimethyl-1-Cyclohexenyl)Benzonitrile; 5,5-Dimethyl-3-(4-Cyanophenyl)-Cyclohex-2-En-1-One; 5,5-Dimethyl-3-(4-Cyanophenyl)Cyclohex-2-Enone
• Molecular Formula: C₁₅H₁₅NO
• Molecular Weight: 225.29
• CAS Registry Number: 72036-56-7
• SMILES: C2=C(C1=CC(=O)CC(C1)(C)C)C=CC(=C2)C#N
• InChI: 1S/C15H15NO/c1-15(2)8-13(7-14(17)9-15)12-5-3-11(10-16)4-6-12/h3-7H,8-9H2,1-2H3
• InChIKey: HQFHRYXMAZCIEF-UHFFFAOYSA-N