1.02010-04-08 22:14:07 UTC2019-11-26 03:17:02 UTCFDB0190627-Methyl-3-octen-2-oneFound in skimmed milk powder. Flavouring agent for a variety of foods, especies for fried food taste(3E)-7-Methyl-3-octen-2-one3-Octen-2-one, 7-methyl-7-Methyloct-3-en-2-oneFEMA 3868C9H16O140.2227140.120115134(3E)-7-methyloct-3-en-2-one(3E)-7-methyloct-3-en-2-one33046-81-0CC(C)CC\C=C\C(C)=OInChI=1S/C9H16O/c1-8(2)6-4-5-7-9(3)10/h5,7-8H,4,6H2,1-3H3/b7-5+QFSMRIFNMXHJQK-FNORWQNLSA-N belongs to the class of organic compounds known as enones. Enones are compounds containing the enone functional group, with the structure RC(=O)CR'.EnonesOrganic compoundsOrganic oxygen compoundsOrganooxygen compoundsCarbonyl compoundsAliphatic acyclic compoundsAcryloyl compoundsHydrocarbon derivativesKetonesOrganic oxidesAcryloyl-groupAliphatic acyclic compoundEnoneHydrocarbon derivativeKetoneOrganic oxidelogp2.85logs-2.59solubility3.58e-01 g/llogp2.87pka_strongest_acidic19.85pka_strongest_basic-4.6iupac(3E)-7-methyloct-3-en-2-oneaverage_mass140.2227mono_mass140.120115134smilesCC(C)CC\C=C\C(C)=OformulaC9H16OinchiInChI=1S/C9H16O/c1-8(2)6-4-5-7-9(3)10/h5,7-8H,4,6H2,1-3H3/b7-5+inchikeyQFSMRIFNMXHJQK-FNORWQNLSA-Npolar_surface_area17.07refractivity44.87polarizability17.71rotatable_bond_count4acceptor_count1donor_count0physiological_charge0formal_charge0Specdb::MsIr8168Specdb::MsIr8169Specdb::CMs14907Specdb::CMs170287Specdb::MsMs62943Specdb::MsMs62944Specdb::MsMs62945Specdb::MsMs119784Specdb::MsMs119785Specdb::MsMs119786Specdb::MsMs2719068Specdb::MsMs2719069Specdb::MsMs2719070Specdb::MsMs2963313Specdb::MsMs2963314Specdb::MsMs2963315HMDB39461#<Reference:0x0000555675fe46f8>Milk and milk productsUnknowngenericfloralfruity