1.02010-04-08 22:12:58 UTC2019-11-26 03:14:30 UTCFDB017236Dihydro-alpha-iononeDihydro-alpha-ionone is a flavouring ingredient for artificial fruit flavours. It is found in peaches, raspberry, Rubus hybrid fruits, Chinese scented green tea and alfalfa extract.(+)-Dihydro-alpha-ionone(R)-(+)-Dihydro-alpha-ionone2-Butanone, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (R)-4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-(R)-2-butanoneFEMA 3628C13H22O194.3132194.1670653264-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]butan-2-one4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]butan-2-one39721-65-8CC(=O)CC[C@H]1C(C)=CCCC1(C)CInChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6,12H,5,7-9H2,1-4H3/t12-/m0/s1JHJCHCSUEGPIGE-LBPRGKRZSA-N belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units.SesquiterpenoidsOrganic compoundsLipids and lipid-like moleculesPrenol lipidsSesquiterpenoidsAliphatic homomonocyclic compoundsHydrocarbon derivativesKetonesOrganic oxidesAliphatic homomonocyclic compoundCarbonyl groupHydrocarbon derivativeKetoneMegastigmane sesquiterpenoidOrganic oxideOrganic oxygen compoundOrganooxygen compoundSesquiterpenoidlogp4.13logs-3.48solubility6.41e-02 g/llogp3.32pka_strongest_acidic19.55pka_strongest_basic-7.3iupac4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]butan-2-oneaverage_mass194.3132mono_mass194.167065326smilesCC(=O)CC[C@H]1C(C)=CCCC1(C)CformulaC13H22OinchiInChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6,12H,5,7-9H2,1-4H3/t12-/m0/s1inchikeyJHJCHCSUEGPIGE-LBPRGKRZSA-Npolar_surface_area17.07refractivity61polarizability23.81rotatable_bond_count3acceptor_count1donor_count0physiological_charge0formal_charge0Specdb::MsIr7789Specdb::MsIr7790Specdb::CMs19375Specdb::CMs173306Specdb::MsMs309055Specdb::MsMs309056Specdb::MsMs309057Specdb::MsMs353392Specdb::MsMs353393Specdb::MsMs353394Specdb::MsMs2434717Specdb::MsMs2434718Specdb::MsMs2434719Specdb::MsMs2504297Specdb::MsMs2504298Specdb::MsMs2504299HMDB38026#<Reference:0x0000555675d8df58>Black teaType 1FruitsUnknowngenericGreen teaType 1Herbal teaType 1Red teaType 1TeaType 1specificCamellia sinensis4442earthyherbalorrisraspberryvioletwarmwoody