1.02011-09-26 22:53:48 UTC2015-07-21 07:00:02 UTCFDB0296602-ethyl-6(or 5)-methylpyrazineFlavouring compound [Flavornet]C7H10N2122.1677122.084398332-ethyl-3-methylpyrazinepyrazine, 2-ethyl-3-methyl-33504-66-4CCC1=C(C)N=CC=N1InChI=1S/C7H10N2/c1-3-7-6(2)8-4-5-9-7/h4-5H,3H2,1-2H3LNIMMWYNSBZESE-UHFFFAOYSA-N belongs to the class of organic compounds known as pyrazines. Pyrazines are compounds containing a pyrazine ring, which is a six-member aromatic heterocycle, that consists of two nitrogen atoms (at positions 1 and 4) and four carbon atoms.PyrazinesOrganic compoundsOrganoheterocyclic compoundsDiazinesPyrazinesAromatic heteromonocyclic compoundsAzacyclic compoundsHeteroaromatic compoundsHydrocarbon derivativesOrganonitrogen compoundsOrganopnictogen compoundsAromatic heteromonocyclic compoundAzacycleHeteroaromatic compoundHydrocarbon derivativeOrganic nitrogen compoundOrganonitrogen compoundOrganopnictogen compoundPyrazinelogp1.20logs-0.17solubility8.17e+01 g/llogp0.5pka_strongest_basic1.52iupac2-ethyl-3-methylpyrazineaverage_mass122.1677mono_mass122.08439833smilesCCC1=C(C)N=CC=N1formulaC7H10N2inchiInChI=1S/C7H10N2/c1-3-7-6(2)8-4-5-9-7/h4-5H,3H2,1-2H3inchikeyLNIMMWYNSBZESE-UHFFFAOYSA-Npolar_surface_area25.78refractivity35.55polarizability13.67rotatable_bond_count1acceptor_count2donor_count0physiological_charge0formal_charge0Specdb::CMs19578Specdb::CMs28914Specdb::CMs102198Specdb::CMs148549Specdb::EiMs1856Specdb::MsIr9167Specdb::MsIr9168Specdb::NmrOneD45702Specdb::NmrOneD45703Specdb::NmrOneD45704Specdb::NmrOneD45705Specdb::NmrOneD45706Specdb::NmrOneD45707Specdb::NmrOneD45708Specdb::NmrOneD45709Specdb::NmrOneD45710Specdb::NmrOneD45711Specdb::NmrOneD45712Specdb::NmrOneD45713Specdb::NmrOneD45714Specdb::NmrOneD45715Specdb::NmrOneD45716Specdb::NmrOneD45717Specdb::NmrOneD45718Specdb::NmrOneD45719Specdb::NmrOneD45720Specdb::NmrOneD45721Specdb::MsMs46245Specdb::MsMs46246Specdb::MsMs46247Specdb::MsMs115386Specdb::MsMs115387Specdb::MsMs115388Specdb::MsMs1476815Specdb::MsMs1476816Specdb::MsMs1476817Specdb::MsMs1476818Specdb::MsMs1476819Specdb::MsMs1476820Specdb::MsMs2444956Specdb::MsMs2444957Specdb::MsMs2444958Specdb::MsMs2521475Specdb::MsMs2521476Specdb::MsMs2521477sweat