1.02010-04-08 22:12:37 UTC2019-11-26 03:13:43 UTCFDB016749xi-Tetrahydro-3-nonyl-2H-pyran-2-onePresent in aroma of date palm fruit (Phoenix dactylifera). xi-Tetrahydro-3-nonyl-2H-pyran-2-one is found in fruits.C14H26O2226.355226.1932800763-nonyloxan-2-one3-nonyloxan-2-oneCCCCCCCCCC1CCCOC1=OInChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-10-13-11-9-12-16-14(13)15/h13H,2-12H2,1H3XLKRUURGHWUVNG-UHFFFAOYSA-N belongs to the class of organic compounds known as delta valerolactones. These are cyclic organic compounds containing an oxan-2- one moiety.Delta valerolactonesOrganic compoundsOrganoheterocyclic compoundsLactonesDelta valerolactonesAliphatic heteromonocyclic compoundsCarbonyl compoundsCarboxylic acid estersHydrocarbon derivativesMonocarboxylic acids and derivativesOrganic oxidesOxacyclic compoundsOxanesAliphatic heteromonocyclic compoundCarbonyl groupCarboxylic acid derivativeCarboxylic acid esterDelta valerolactoneDelta_valerolactoneHydrocarbon derivativeMonocarboxylic acid or derivativesOrganic oxideOrganic oxygen compoundOrganooxygen compoundOxacycleOxanelogp5.39logs-5.10solubility1.78e-03 g/llogp4.69pka_strongest_basic-7.1iupac3-nonyloxan-2-oneaverage_mass226.355mono_mass226.193280076smilesCCCCCCCCCC1CCCOC1=OformulaC14H26O2inchiInChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-10-13-11-9-12-16-14(13)15/h13H,2-12H2,1H3inchikeyXLKRUURGHWUVNG-UHFFFAOYSA-Npolar_surface_area26.3refractivity66.29polarizability28.72rotatable_bond_count8acceptor_count1donor_count0physiological_charge0formal_charge0Specdb::CMs19175Specdb::CMs135234Specdb::CMs142968Specdb::MsMs79767Specdb::MsMs79768Specdb::MsMs79769Specdb::MsMs140430Specdb::MsMs140431Specdb::MsMs140432Specdb::MsMs2293941Specdb::MsMs2293942Specdb::MsMs2293943Specdb::MsMs2640829Specdb::MsMs2640830Specdb::MsMs2640831HMDB37633#<Reference:0x0000555674a9ddf8>FruitsUnknowngeneric