1.0 2010-04-08 22:11:30 UTC 2015-07-20 23:11:51 UTC FDB014841 Etaspirene Fragrance ingredient with a blackcurrant-like aroma 1-Oxaspiro(4.5)deca-3,6-diene, 6-ethyl-2,10,10-trimethyl- 6-Ethyl-2,10,10-trimethyl-1-oxaspiro(4.5)deca-3,6-diene Etaspirene C14H22O 206.3239 206.167065326 6-ethyl-2,10,10-trimethyl-1-oxaspiro[4.5]deca-3,6-diene 6-ethyl-2,10,10-trimethyl-1-oxaspiro[4.5]deca-3,6-diene 79893-63-3 CCC1=CCCC(C)(C)C11OC(C)C=C1 InChI=1S/C14H22O/c1-5-12-7-6-9-13(3,4)14(12)10-8-11(2)15-14/h7-8,10-11H,5-6,9H2,1-4H3 NHJSLVJXXDHDRV-UHFFFAOYSA-N belongs to the class of organic compounds known as dihydrofurans. Dihydrofurans are compounds containing a dihydrofuran moiety, which is a furan derivative with only one double bond. Dihydrofurans Organic compounds Organoheterocyclic compounds Dihydrofurans Aliphatic heteropolycyclic compounds Dialkyl ethers Hydrocarbon derivatives Oxacyclic compounds Aliphatic heteropolycyclic compound Dialkyl ether Dihydrofuran Ether Hydrocarbon derivative Organic oxygen compound Organooxygen compound Oxacycle logp 4.52 ALOGPS logs -3.96 ALOGPS solubility 2.26e-02 g/l ALOGPS logp 3.84 ChemAxon pka_strongest_basic -4.3 ChemAxon iupac 6-ethyl-2,10,10-trimethyl-1-oxaspiro[4.5]deca-3,6-diene ChemAxon average_mass 206.3239 ChemAxon mono_mass 206.167065326 ChemAxon smiles CCC1=CCCC(C)(C)C11OC(C)C=C1 ChemAxon formula C14H22O ChemAxon inchi InChI=1S/C14H22O/c1-5-12-7-6-9-13(3,4)14(12)10-8-11(2)15-14/h7-8,10-11H,5-6,9H2,1-4H3 ChemAxon inchikey NHJSLVJXXDHDRV-UHFFFAOYSA-N ChemAxon polar_surface_area 9.23 ChemAxon refractivity 65.4 ChemAxon polarizability 24.65 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 13149 Specdb::CMs 159727 Specdb::MsMs 94920 Specdb::MsMs 94921 Specdb::MsMs 94922 Specdb::MsMs 159060 Specdb::MsMs 159061 Specdb::MsMs 159062 Specdb::MsMs 2305020 Specdb::MsMs 2305021 Specdb::MsMs 2305022 Specdb::MsMs 2657221 Specdb::MsMs 2657222 Specdb::MsMs 2657223 HMDB36023 #<Reference:0x000055ce32263cb0> blackcurrant