4-(2,6,6-trimethyl-4-oxidanyl-cyclohexen-1-yl)but-3-yn-2-one

Systemtic Name: 4-(2,6,6-trimethyl-4-oxidanyl-cyclohexen-1-yl)but-3-yn-2-one Openeye Name: 4-(4-hydroxy-2,6,6-trimethyl-cyclohexen-1-yl)but-3-yn-2-one CAS Name: 4-(4-hydroxy-2,6,6-trimethyl-1-cyclohexenyl)-3-butyn-2-one IUPAC Name: 4-(4-hydroxy-2,6,6-trimethylcyclohexen-1-yl)but-3-yn-2-one Traditional Name: 4-(4-hydroxy-2,6,6-trimethyl-cyclohexen-1-yl)but-3-yn-2-one Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(C1)O)(C)C)C#CC(=O)C

Isomeric SMILES

CC1=C(C(CC(C1)O)(C)C)C#CC(=O)C

InChI

InChI=1S/C13H18O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h11,15H,7-8H2,1-4H3