(3R,5S)-1-tert-butyl-4-fluoranyl-adamantane

Systemtic Name: (3R,5S)-1-tert-butyl-4-fluoranyl-adamantane Openeye Name: (3R,5S)-1-tert-butyl-4-fluoro-adamantane CAS Name: (3R,5S)-1-tert-butyl-4-fluoroadamantane IUPAC Name: (3R,5S)-1-tert-butyl-4-fluoroadamantane Traditional Name: (3R,5S)-1-tert-butyl-4-fluoro-adamantane Formula: C14H23F MolecularWeight: 210.330823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C12CC3CC(C1)C(C(C3)C2)F

Isomeric SMILES

CC(C)(C)C12C[C@H]3CC(C1)C[C@@H](C2)C3F

InChI

InChI=1S/C14H23F/c1-13(2,3)14-6-9-4-10(7-14)12(15)11(5-9)8-14/h9-12H,4-8H2,1-3H3/t9?,10-,11+,12?,14?