1.02010-04-08 22:11:59 UTC2019-11-26 03:12:01 UTCFDB015673beta-PatchouleneConstituent of guaiac wood oil (Bulnesia sarmienti). beta-Patchoulene is found in herbs and spices.β-Patchoulene1,2,3,4,5,6,7,8-Octahydro-1,4,9,9-tetramethyl-4,7-methanoazulene, 9CIb-Patchoulenebeta-PatchouleneC15H24204.3511204.1878007681,5,11,11-tetramethyltricyclo[6.2.1.0²,⁶]undec-2(6)-ene1,5,11,11-tetramethyltricyclo[6.2.1.0²,⁶]undec-2(6)-ene514-51-2CC1CCC2=C1CC1CCC2(C)C1(C)CInChI=1S/C15H24/c1-10-5-6-13-12(10)9-11-7-8-15(13,4)14(11,2)3/h10-11H,5-9H2,1-4H3CSKINCSXMLCMAR-UHFFFAOYSA-N belongs to the class of organic compounds known as polycyclic hydrocarbons. These are polycyclic organic compounds made up only of carbon and hydrogen atoms.Polycyclic hydrocarbonsOrganic compoundsHydrocarbonsPolycyclic hydrocarbonsAliphatic homopolycyclic compoundsCyclic olefinsUnsaturated aliphatic hydrocarbonsAliphatic homopolycyclic compoundCyclic olefinOlefinPolycyclic hydrocarbonUnsaturated aliphatic hydrocarbonUnsaturated hydrocarbona sesquiterpenoidlogp5.68logs-4.23solubility1.22e-02 g/llogp4.06iupac1,5,11,11-tetramethyltricyclo[6.2.1.0²,⁶]undec-2(6)-eneaverage_mass204.3511mono_mass204.187800768smilesCC1CCC2=C1CC1CCC2(C)C1(C)CformulaC15H24inchiInChI=1S/C15H24/c1-10-5-6-13-12(10)9-11-7-8-15(13,4)14(11,2)3/h10-11H,5-9H2,1-4H3inchikeyCSKINCSXMLCMAR-UHFFFAOYSA-Npolar_surface_area0refractivity65.43polarizability25.68rotatable_bond_count0acceptor_count0donor_count0physiological_charge0formal_charge0Specdb::CMs16242Specdb::CMs160546Specdb::MsMs9605Specdb::MsMs9606Specdb::MsMs9607Specdb::MsMs16277Specdb::MsMs16278Specdb::MsMs16279Specdb::MsMs3042628Specdb::MsMs3042629Specdb::MsMs3042630Specdb::MsMs3097132Specdb::MsMs3097133Specdb::MsMs3097134HMDB36736#<Reference:0x00005556761a4d58>Herbs and SpicesUnknowngeneric