1.02010-04-08 22:05:19 UTC2019-11-26 02:57:17 UTCFDB002292Linalyl isovalerateLinalyl isovalerate is used in perfumery and food flavouring. It is found in herbs and spices such as Salvia spp. (Salvia officinalis) also know as common sage.1,5-Dimethyl-1-vinyl-4-hexenyl 3-methylbutanoate1,6-Octadien-3-ol, 4,7-dimethyl-, isovalerate3,7-Dimethyl-1,6-octadien-3-yl isovalerateFEMA 2646Linalyl 3-methylbutanoateLinalyl iso-valerateLinalyl isovalerateC15H26O2238.3657238.1932800763,7-dimethylocta-1,6-dien-3-yl 3-methylbutanoate3,7-dimethylocta-1,6-dien-3-yl 3-methylbutanoate1118-27-0CC(C)CC(=O)OC(C)(CCC=C(C)C)C=CInChI=1S/C15H26O2/c1-7-15(6,10-8-9-12(2)3)17-14(16)11-13(4)5/h7,9,13H,1,8,10-11H2,2-6H3WCDGWAIZRYMVOW-UHFFFAOYSA-N belongs to the class of organic compounds known as acyclic monoterpenoids. These are monoterpenes that do not contain a cycle.Acyclic monoterpenoidsOrganic compoundsLipids and lipid-like moleculesPrenol lipidsMonoterpenoidsAliphatic acyclic compoundsCarbonyl compoundsCarboxylic acid estersFatty acid estersHydrocarbon derivativesMonocarboxylic acids and derivativesOrganic oxidesAcyclic monoterpenoidAliphatic acyclic compoundCarbonyl groupCarboxylic acid derivativeCarboxylic acid esterFatty acid esterFatty acylHydrocarbon derivativeMonocarboxylic acid or derivativesOrganic oxideOrganic oxygen compoundOrganooxygen compoundLiquidlogp4.83logs-4.46solubility8.26e-03 g/llogp4.52pka_strongest_basic-7.1iupac3,7-dimethylocta-1,6-dien-3-yl 3-methylbutanoateaverage_mass238.3657mono_mass238.193280076smilesCC(C)CC(=O)OC(C)(CCC=C(C)C)C=CformulaC15H26O2inchiInChI=1S/C15H26O2/c1-7-15(6,10-8-9-12(2)3)17-14(16)11-13(4)5/h7,9,13H,1,8,10-11H2,2-6H3inchikeyWCDGWAIZRYMVOW-UHFFFAOYSA-Npolar_surface_area26.3refractivity73.13polarizability28.74rotatable_bond_count8acceptor_count1donor_count0physiological_charge0formal_charge0Specdb::CMs13017Specdb::CMs28619Specdb::CMs100548Specdb::CMs134010Specdb::CMs141744Specdb::MsMs53913Specdb::MsMs53914Specdb::MsMs53915Specdb::MsMs159882Specdb::MsMs159883Specdb::MsMs159884Specdb::MsMs2746082Specdb::MsMs2746083Specdb::MsMs2746084Specdb::MsMs2936773Specdb::MsMs2936774Specdb::MsMs2936775HMDB30428#<Reference:0x00005556740bbd58>Herbs and SpicesUnknowngenericappleapricotbergamotcitruslavenderpeachsagesweet