1.0 2010-04-08 22:10:58 UTC 2019-11-26 03:09:17 UTC FDB013910 Myrtenal Occurs in orange, lemon, spearmint, pepper, thyme, juniper, calamus, ginger, myrtle, lemon balm, calabash, nutmeg, parsley seed and other plant oils. Myrtenal is found in many foods, some of which are peppermint, fruits, wild celery, and sweet bay. 2-Formyl-6,6-dimethylbicyclo(3.1.1)hept-2-ene 6,6-Dimethyl-bicyclo[3,1,1]hept-2-ene-2-carboxaldehyde FEMA 3395 Myrtenal C10H14O 150.2176 150.10446507 6,6-dimethylbicyclo[3.1.1]hept-2-ene-2-carbaldehyde myrtenal 23727-16-4 CC1(C)C2CC1C(C=O)=CC2 InChI=1S/C10H14O/c1-10(2)8-4-3-7(6-11)9(10)5-8/h3,6,8-9H,4-5H2,1-2H3 KMRMUZKLFIEVAO-UHFFFAOYSA-N belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other. Bicyclic monoterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Monoterpenoids Aliphatic homopolycyclic compounds Aldehydes Hydrocarbon derivatives Organic oxides Aldehyde Aliphatic homopolycyclic compound Bicyclic monoterpenoid Carbonyl group Hydrocarbon derivative Organic oxide Organic oxygen compound Organooxygen compound Pinane monoterpenoid Bicyclic monoterpenoids Bicyclic monoterpenoids Cyclic monoterpenes monoterpenoid logp 3.03 ALOGPS logs -2.22 ALOGPS solubility 8.96e-01 g/l ALOGPS logp 1.83 ChemAxon pka_strongest_basic -4.5 ChemAxon iupac 6,6-dimethylbicyclo[3.1.1]hept-2-ene-2-carbaldehyde ChemAxon average_mass 150.2176 ChemAxon mono_mass 150.10446507 ChemAxon smiles CC1(C)C2CC1C(C=O)=CC2 ChemAxon formula C10H14O ChemAxon inchi InChI=1S/C10H14O/c1-10(2)8-4-3-7(6-11)9(10)5-8/h3,6,8-9H,4-5H2,1-2H3 ChemAxon inchikey KMRMUZKLFIEVAO-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 45.51 ChemAxon polarizability 17.27 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 6890 Specdb::MsIr 6891 Specdb::CMs 23118 Specdb::CMs 29233 Specdb::CMs 101729 Specdb::CMs 166646 Specdb::MsMs 106308 Specdb::MsMs 106309 Specdb::MsMs 106310 Specdb::MsMs 173010 Specdb::MsMs 173011 Specdb::MsMs 173012 Specdb::MsMs 2844923 Specdb::MsMs 2844924 Specdb::MsMs 2844925 Specdb::MsMs 2860678 Specdb::MsMs 2860679 Specdb::MsMs 2860680 HMDB35250 #<Reference:0x0000561273016ba8> Blackberry Type 1 specific Rubus Cardamom Type 1 specific Elettaria cardamomum 105181 Citrus Unknown generic Coriander Type 1 specific Coriandrum sativum 4047 Evergreen blackberry Type 1 specific Rubus laciniatus Fruits Unknown generic Ginger Type 1 specific Zingiber officinale 94328 1.525 1.525 1.525 mg/100 g Herbs and Spices Unknown generic Hyssop Type 1 specific Hyssopus officinalis 39324 2.7 2.7 2.7 mg/100 g Pepper (Spice) Type 1 specific Piper nigrum 13216 Peppermint Type 1 specific Mentha X piperita 34256 0.0011 0.0011 0.0011 mg/100 g Roman camomile Type 1 specific Chamaemelum nobile 99037 Spearmint Type 1 specific Mentha spicata 29719 5.05 5.05 5.05 mg/100 g Sunflower Type 1 specific Helianthus annuus 4232 Sweet bay Type 1 specific Laurus nobilis 85223 Wild celery Type 1 specific Apium graveolens 4045 camphor cinnamon jam lime pepper spice spicy sweet terpene tonka anti malarial 416 A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans. anti plasmodial 532 A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans. herbicide 986 A substance used to destroy plant pests. perfumery 1206 A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell. pesticide 1210 Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.