1.02010-04-08 22:14:42 UTC2019-11-26 03:18:10 UTCFDB0199591-Propenyl propyl sulfideVolatile constituent of Welsh onion, scallions, leek, garlic and shallots. Usually present as a mixture of (E)- and (Z)-isomers. 1-Propenyl propyl sulfide is found in onion-family vegetables.(1E)-1-(Propylsulfanyl)-1-propene1-(Propylthio)-1-propene, 9CI4-Thia-2-hepteneC6H12S116.224116.065971074(1E)-1-(propylsulfanyl)prop-1-ene(1E)-1-(propylsulfanyl)prop-1-ene33922-70-2CCCS\C=C\CInChI=1S/C6H12S/c1-3-5-7-6-4-2/h3,5H,4,6H2,1-2H3/b5-3+RKVNNVDQIVWRNA-HWKANZROSA-N belongs to the class of organic compounds known as thioenol ethers. Thioenol ethers are compounds containing the enol ether functional group, with the formula R3SCR2=CR1.Thioenol ethersOrganic compoundsOrganosulfur compoundsThioethersThioenol ethersAliphatic acyclic compoundsHydrocarbon derivativesSulfenyl compoundsAliphatic acyclic compoundHydrocarbon derivativeSulfenyl compoundThioenoletherlogp3.36logs-2.61solubility2.82e-01 g/llogp2.5iupac(1E)-1-(propylsulfanyl)prop-1-eneaverage_mass116.224mono_mass116.065971074smilesCCCS\C=C\CformulaC6H12SinchiInChI=1S/C6H12S/c1-3-5-7-6-4-2/h3,5H,4,6H2,1-2H3/b5-3+inchikeyRKVNNVDQIVWRNA-HWKANZROSA-Npolar_surface_area0refractivity37.82polarizability14.47rotatable_bond_count3acceptor_count0donor_count0physiological_charge0formal_charge0Specdb::MsIr8833Specdb::MsIr8834Specdb::CMs24735Specdb::CMs157679Specdb::MsMs320758Specdb::MsMs320759Specdb::MsMs320760Specdb::MsMs368209Specdb::MsMs368210Specdb::MsMs368211Specdb::MsMs2343962Specdb::MsMs2343963Specdb::MsMs2343964Specdb::MsMs2595493Specdb::MsMs2595494Specdb::MsMs2595495HMDB40244#<Reference:0x00005556761b06f8>Garden onionType 1specificAllium cepa4679Garden onion (var.)Type 1specificAllium cepa var. cepa4679Green onionType 1Onion-family vegetablesUnknowngenericRed onionType 1Welsh onionType 1specificAllium fistulosum35875