{"pubchem_id": 22311, "iupac_name": "1-methyl-4-prop-1-en-2-ylcyclohexene", "common_name": "Dipentene", "smile": "CC1=CCC(CC1)C(=C)C", "molecular_weight": 136.238, "hbd_count": 0, "hba_count": 0, "num_rotatablebonds": 1, "complexity": 163.0, "topological_polor_surfacearea": 0.0, "monoisotopic_mass": 136.125, "exact_mass": 136.125, "xlogp": "3.4", "charge": 0, "heavy_atom_count": 10, "atom_stereo_count": 1, "defined_atom_stereocenter_count": 0, "undefined_atom_stereocenter_count": 1, "bond_stereo_count": 0, "defined_bond_stereocenter_count": 0, "undefined_bond_stereocenter_count": 0, "isotope_atom_count": 0, "covalently_bonded_unit_count": 1, "cas_id": "7705-14-8@9003-73-0@8008-56-8@65996-98-7@8008-57-9@138-86-3@8028-38-4@0008008-57-9", "fema_number": "2625", "fema_flavor_profile": null, "odor": "characteristic odor ... becoming more pronounced and less agreeable on aging or exposure to air@penetrating odor@acquires terebinthinate odor upon oxidation@pleasant lemon-like@characteristic orange odor@characteristic odor of orange peels@citrus odor", "taste": "characteristic ... taste, ... becoming more pronounced and less agreeable on aging or exposure to air@sweet, citrus taste@characteristic orange taste@fresh, citrus taste", "functional_groups": "alkene", "inchi": "InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3", "volume3d": "122.9", "fooddb_flavor_profile": "lemon@citrus@orange@herbal@woody@terpene@citric@camphor", "super_sweet": null, "bitter": 0, "supersweetdb_id": null, "bitterdb_id": null, "fooddb_id": "FDB014115", "flavornet_id": 1, "fenoroli_and_os": 1, "natural": 1, "unknown_natural": 0, "synthetic": 0, "flavor_profile": "lemon@citrus@orange@herbal@woody@terpene@citric@camphor"}