1.02010-04-08 22:12:43 UTC2019-11-26 03:13:55 UTCFDB0169053-Acetylmercaptohexyl acetateIsolated from yellow passion fruit (Passiflora edulis). Flavouring ingredient. 3-Acetylmercaptohexyl acetate is found in fruits.3-Acetylmercaptohexyl acetateFEMA 3816S-[1-[2-(Acetyloxy)ethyl]butyl] ethanethioateC10H18O3S218.313218.097665132136954-25-1CCCC(CCOC(C)=O)SC(C)=OInChI=1S/C10H18O3S/c1-4-5-10(14-9(3)12)6-7-13-8(2)11/h10H,4-7H2,1-3H3GSJSVAFGVJLTNQ-UHFFFAOYSA-N belongs to the class of organic compounds known as thioesters. These are organic compounds containing an ester of thiocarboxylic acid, with the general structure RC(=S)XR' (R=H, alkyl, aryl; R'=alkyl, aryl; X=O,S).ThioestersOrganic compoundsOrganic acids and derivativesThiocarboxylic acids and derivativesThioestersAliphatic acyclic compoundsCarbonyl compoundsCarbothioic S-estersCarboxylic acid estersHydrocarbon derivativesMonocarboxylic acids and derivativesOrganic oxidesSulfenyl compoundsAliphatic acyclic compoundCarbonyl groupCarbothioic s-esterCarboxylic acid derivativeCarboxylic acid esterHydrocarbon derivativeMonocarboxylic acid or derivativesOrganic oxideOrganic oxygen compoundOrganooxygen compoundOrganosulfur compoundSulfenyl compoundThiocarboxylic acid esteraverage_mass218.313mono_mass218.097665132smilesCCCC(CCOC(C)=O)SC(C)=OformulaC10H18O3SinchiInChI=1S/C10H18O3S/c1-4-5-10(14-9(3)12)6-7-13-8(2)11/h10H,4-7H2,1-3H3inchikeyGSJSVAFGVJLTNQ-UHFFFAOYSA-NSpecdb::CMs15335Specdb::CMs153164Specdb::MsMs87732Specdb::MsMs87733Specdb::MsMs87734Specdb::MsMs150297Specdb::MsMs150298Specdb::MsMs150299Specdb::MsMs2315030Specdb::MsMs2315031Specdb::MsMs2315032Specdb::MsMs2620253Specdb::MsMs2620254Specdb::MsMs2620255HMDB37764#<Reference:0x0000555675c5b9c8>FruitsUnknowngenericbuchucattyfruitymetallicsulfurysweettropical