1.02011-09-26 22:55:40 UTC2015-07-21 07:00:49 UTCFDB029744caryophyllene alcoholFlavouring compound [Flavornet]C15H26O222.372222.198365457(1R,2S,5R,8S)-4,4,8-trimethyltricyclo[6.3.1.0²,⁵]dodecan-1-ol(1R,2S,5R,8S)-4,4,8-trimethyltricyclo[6.3.1.0²,⁵]dodecan-1-ol56747-96-7[H][C@]12CC(C)(C)[C@]1([H])CC[C@]1(C)CCC[C@@]2(O)C1InChI=1S/C15H26O/c1-13(2)9-12-11(13)5-8-14(3)6-4-7-15(12,16)10-14/h11-12,16H,4-10H2,1-3H3/t11-,12+,14+,15-/m1/s1FUQAYSQLAOJBBC-PAPYEOQZSA-N belongs to the class of organic compounds known as tertiary alcohols. Tertiary alcohols are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ).Tertiary alcoholsOrganic compoundsOrganic oxygen compoundsOrganooxygen compoundsAlcohols and polyolsAliphatic homopolycyclic compoundsCyclic alcohols and derivativesHydrocarbon derivativesAliphatic homopolycyclic compoundCyclic alcoholHydrocarbon derivativeTertiary alcohollogp3.52logs-4.38solubility9.33e-03 g/llogp3.43pka_strongest_basic-0.19iupac(1R,2S,5R,8S)-4,4,8-trimethyltricyclo[6.3.1.0²,⁵]dodecan-1-olaverage_mass222.372mono_mass222.198365457smiles[H][C@]12CC(C)(C)[C@]1([H])CC[C@]1(C)CCC[C@@]2(O)C1formulaC15H26OinchiInChI=1S/C15H26O/c1-13(2)9-12-11(13)5-8-14(3)6-4-7-15(12,16)10-14/h11-12,16H,4-10H2,1-3H3/t11-,12+,14+,15-/m1/s1inchikeyFUQAYSQLAOJBBC-PAPYEOQZSA-Npolar_surface_area20.23refractivity66.5polarizability27.41rotatable_bond_count0acceptor_count1donor_count1physiological_charge0formal_charge0Specdb::MsMs103299Specdb::MsMs103300Specdb::MsMs103301Specdb::MsMs169305Specdb::MsMs169306Specdb::MsMs169307Specdb::MsMs3607354Specdb::MsMs3607355Specdb::MsMs3607356Specdb::MsMs3607357Specdb::MsMs3607358Specdb::MsMs3607359earthearthymossspicespicy