1.02011-09-26 22:55:16 UTC2015-07-21 07:00:40 UTCFDB029725(E)-p-mentha-1(7),8-dien-2-hydroperoxideFlavouring compound [Flavornet]C10H16O2168.236168.115029755(1R,5S)-2-methylidene-5-(prop-1-en-2-yl)cyclohexane-1-peroxol(1R,5S)-2-methylidene-5-(prop-1-en-2-yl)cyclohexane-1-peroxol77026-83-6[H][C@@]1(CCC(=C)[C@@]([H])(C1)OO)C(C)=CInChI=1S/C10H16O2/c1-7(2)9-5-4-8(3)10(6-9)12-11/h9-11H,1,3-6H2,2H3/t9-,10+/m0/s1CSOZFPOODGAASP-VHSXEESVSA-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 compoundsAlkyl hydroperoxidesHydrocarbon derivativesMonocyclic monoterpenoidsPeroxolsAliphatic homomonocyclic compoundAlkyl hydroperoxideHydrocarbon derivativeHydroperoxideMonocyclic monoterpenoidOrganic oxygen compoundOrganooxygen compoundP-menthane monoterpenoidPeroxollogp2.66logs-2.02solubility1.60e+00 g/llogp2.5pka_strongest_acidic11.71pka_strongest_basic-4.2iupac(1R,5S)-2-methylidene-5-(prop-1-en-2-yl)cyclohexane-1-peroxolaverage_mass168.236mono_mass168.115029755smiles[H][C@@]1(CCC(=C)[C@@]([H])(C1)OO)C(C)=CformulaC10H16O2inchiInChI=1S/C10H16O2/c1-7(2)9-5-4-8(3)10(6-9)12-11/h9-11H,1,3-6H2,2H3/t9-,10+/m0/s1inchikeyCSOZFPOODGAASP-VHSXEESVSA-Npolar_surface_area29.46refractivity48.27polarizability18.81rotatable_bond_count2acceptor_count2donor_count1physiological_charge0formal_charge0Specdb::MsMs1315849Specdb::MsMs1315850Specdb::MsMs1315851Specdb::MsMs1430314Specdb::MsMs1430315Specdb::MsMs1430316Specdb::MsMs3607282Specdb::MsMs3607283Specdb::MsMs3607284Specdb::MsMs3607285Specdb::MsMs3607286Specdb::MsMs3607287turpentine