1.02010-04-08 22:08:14 UTC2015-07-20 22:25:54 UTCFDB008759alpha-Terpinyl pentanoateProb. a flavouring agent(±)-p-Menth-1-en-8-yl pentanoate1-Methyl-1-(4-methylcyclohex-3-enyl)ethyl valeratealpha-Terpinyl pentanoateTerpenyl pentanoateTerpinyl valerateValeric acid, p-menth-1-en-8-yl esterC15H26O2238.3657238.1932800762-(4-methylcyclohex-3-en-1-yl)propan-2-yl pentanoate2-(4-methylcyclohex-3-en-1-yl)propan-2-yl pentanoate14481-55-1CCCCC(=O)OC(C)(C)C1CCC(C)=CC1InChI=1S/C15H26O2/c1-5-6-7-14(16)17-15(3,4)13-10-8-12(2)9-11-13/h8,13H,5-7,9-11H2,1-4H3GIHNOWFSKYCHNL-UHFFFAOYSA-N belongs to the class of organic compounds known as menthane monoterpenoids. These are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes.Menthane monoterpenoidsOrganic compoundsLipids and lipid-like moleculesPrenol lipidsMonoterpenoidsAliphatic homomonocyclic compoundsCarbonyl compoundsCarboxylic acid estersFatty acid estersHydrocarbon derivativesMonocarboxylic acids and derivativesMonocyclic monoterpenoidsOrganic oxidesAliphatic homomonocyclic compoundCarbonyl groupCarboxylic acid derivativeCarboxylic acid esterFatty acid esterFatty acylHydrocarbon derivativeMonocarboxylic acid or derivativesMonocyclic monoterpenoidOrganic oxideOrganic oxygen compoundOrganooxygen compoundP-menthane monoterpenoidlogp4.93logs-4.08solubility2.00e-02 g/llogp4.21pka_strongest_basic-7iupac2-(4-methylcyclohex-3-en-1-yl)propan-2-yl pentanoateaverage_mass238.3657mono_mass238.193280076smilesCCCCC(=O)OC(C)(C)C1CCC(C)=CC1formulaC15H26O2inchiInChI=1S/C15H26O2/c1-5-6-7-14(16)17-15(3,4)13-10-8-12(2)9-11-13/h8,13H,5-7,9-11H2,1-4H3inchikeyGIHNOWFSKYCHNL-UHFFFAOYSA-Npolar_surface_area26.3refractivity71.44polarizability28.77rotatable_bond_count6acceptor_count1donor_count0physiological_charge0formal_charge0Specdb::CMs23779Specdb::CMs155246Specdb::MsMs102867Specdb::MsMs102868Specdb::MsMs102869Specdb::MsMs168753Specdb::MsMs168754Specdb::MsMs168755Specdb::MsMs2668594Specdb::MsMs2668595Specdb::MsMs2668596Specdb::MsMs3013271Specdb::MsMs3013272Specdb::MsMs3013273HMDB32054#<Reference:0x0000555675bd6a48>floralfruity