(E)-1-(2-fluoranyl-1-adamantyl)-5,5-dimethyl-hex-2-en-1-one

Systemtic Name: (E)-1-(2-fluoranyl-1-adamantyl)-5,5-dimethyl-hex-2-en-1-one Openeye Name: (E)-1-(2-fluoro-1-adamantyl)-5,5-dimethyl-hex-2-en-1-one CAS Name: (E)-1-(2-fluoro-1-adamantyl)-5,5-dimethyl-2-hexen-1-one IUPAC Name: (E)-1-(2-fluoro-1-adamantyl)-5,5-dimethylhex-2-en-1-one Traditional Name: (E)-1-(2-fluoro-1-adamantyl)-5,5-dimethyl-hex-2-en-1-one Formula: C18H27FO MolecularWeight: 278.404783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC=CC(=O)C12CC3CC(C1)CC(C3)C2F

Isomeric SMILES

CC(C)(C)C/C=C/C(=O)C12CC3CC(C1)CC(C3)C2F

InChI

InChI=1S/C18H27FO/c1-17(2,3)6-4-5-15(20)18-10-12-7-13(11-18)9-14(8-12)16(18)19/h4-5,12-14,16H,6-11H2,1-3H3/b5-4+