1.02010-04-08 22:09:21 UTC2019-11-26 03:04:15 UTCFDB0108992-(Methylthiomethyl)furanMinor constituent of aroma of coffee, also present in smoked cured pork and pork liver. Flavour ingredient. 2-(Methylthiomethyl)furan is found in coffee and coffee products and animal foods.2-((methylthio)Methyl)-furan2-((Methylthio)methyl)furan2-(Methylthio)methylfuran2-(Methylthiomethyl)furan2-[(Methylsulfanyl)methyl]furan2-[(methylthio)Methyl]-furan2-[(methylthio)Methyl]furan2-furfuryl methyl sulfide2-Furfuryl methyl sulphideFEMA 3160Furan, 2-((methylthio)methyl)-Furan, 2-[(methylthio)methyl]-Furfuryl methyl sulfideMethyl furfuryl sulfideC6H8OS128.192128.0295855682-[(methylsulfanyl)methyl]furan2-[(methylsulfanyl)methyl]furan1438-91-1CSCC1=CC=CO1InChI=1S/C6H8OS/c1-8-5-6-3-2-4-7-6/h2-4H,5H2,1H3SKSFHXVDHVKIBN-UHFFFAOYSA-Nlogp1.79logs-2.23solubility7.53e-01 g/llogp1.75pka_strongest_basic-2.9iupac2-[(methylsulfanyl)methyl]furanaverage_mass128.192mono_mass128.029585568smilesCSCC1=CC=CO1formulaC6H8OSinchiInChI=1S/C6H8OS/c1-8-5-6-3-2-4-7-6/h2-4H,5H2,1H3inchikeySKSFHXVDHVKIBN-UHFFFAOYSA-Npolar_surface_area13.14refractivity36.1polarizability13.9rotatable_bond_count2acceptor_count0donor_count0physiological_charge0formal_charge0Specdb::NmrOneD4457Specdb::NmrOneD4578Specdb::CMs23841Specdb::CMs169942Specdb::MsIr5782Specdb::MsIr5783Specdb::MsMs103665Specdb::MsMs103666Specdb::MsMs103667Specdb::MsMs169776Specdb::MsMs169777Specdb::MsMs169778Specdb::MsMs3039775Specdb::MsMs3039776Specdb::MsMs3039777Specdb::MsMs3100761Specdb::MsMs3100762Specdb::MsMs3100763HMDB32916#<Reference:0x00005556748f1720>Arabica coffeeType 1specificCoffea arabica13443Coffee and coffee productsUnknowngenericRobusta coffeeType 1specificCoffea canephora49390garlichorseradishonionpungentsulfuryvegetable