1.0 2010-04-08 22:09:22 UTC 2019-11-26 03:04:19 UTC FDB010931 3,5-Diethyl-2-methylpyrazine Found in potato, chicken, beef and pork, tea, coffee, galbanum oil and other foods. Flavouring agent 2-Methyl-3,5-diethylpyrazine 2,6-Diethyl-3-methylpyrazine 2,6-Diethyl-5-methylpyrazine 3,5-Diethyl-2-methyl-pyrazine FEMA 3916 Pyrazine, 3,5-diethyl-2-methyl- C9H14N2 150.2209 150.115698458 3,5-diethyl-2-methylpyrazine 3,5-diethyl-2-methylpyrazine 18138-05-1 CCC1=NC(CC)=C(C)N=C1 InChI=1S/C9H14N2/c1-4-8-6-10-7(3)9(5-2)11-8/h6H,4-5H2,1-3H3 MRWLZECVHMHMGI-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. Pyrazines Organic compounds Organoheterocyclic compounds Diazines Pyrazines Aromatic heteromonocyclic compounds Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds Aromatic heteromonocyclic compound Azacycle Heteroaromatic compound Hydrocarbon derivative Organic nitrogen compound Organonitrogen compound Organopnictogen compound Pyrazine logp 2.18 ALOGPS logs -1.26 ALOGPS solubility 8.25e+00 g/l ALOGPS logp 1.33 ChemAxon pka_strongest_basic 1.78 ChemAxon iupac 3,5-diethyl-2-methylpyrazine ChemAxon average_mass 150.2209 ChemAxon mono_mass 150.115698458 ChemAxon smiles CCC1=NC(CC)=C(C)N=C1 ChemAxon formula C9H14N2 ChemAxon inchi InChI=1S/C9H14N2/c1-4-8-6-10-7(3)9(5-2)11-8/h6H,4-5H2,1-3H3 ChemAxon inchikey MRWLZECVHMHMGI-UHFFFAOYSA-N ChemAxon polar_surface_area 25.78 ChemAxon refractivity 44.77 ChemAxon polarizability 17.84 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 5826 Specdb::MsIr 5827 Specdb::EiMs 1890 Specdb::CMs 21325 Specdb::CMs 160389 Specdb::NmrOneD 116878 Specdb::NmrOneD 116879 Specdb::NmrOneD 116880 Specdb::NmrOneD 116881 Specdb::NmrOneD 116882 Specdb::NmrOneD 116883 Specdb::NmrOneD 116884 Specdb::NmrOneD 116885 Specdb::NmrOneD 116886 Specdb::NmrOneD 116887 Specdb::NmrOneD 116888 Specdb::NmrOneD 116889 Specdb::NmrOneD 116890 Specdb::NmrOneD 116891 Specdb::NmrOneD 116892 Specdb::NmrOneD 116893 Specdb::NmrOneD 116894 Specdb::NmrOneD 116895 Specdb::NmrOneD 116896 Specdb::NmrOneD 116897 Specdb::MsMs 55485 Specdb::MsMs 55486 Specdb::MsMs 55487 Specdb::MsMs 110640 Specdb::MsMs 110641 Specdb::MsMs 110642 Specdb::MsMs 2810336 Specdb::MsMs 2810337 Specdb::MsMs 2810338 Specdb::MsMs 2894756 Specdb::MsMs 2894757 Specdb::MsMs 2894758 HMDB32946 #<Reference:0x000055ce31e7d9c0> Arabica coffee Type 1 specific Coffea arabica 13443 Black tea Type 1 Coffee and coffee products Unknown generic Green tea Type 1 Herbal tea Type 1 Herbs and Spices Unknown generic Potato Type 1 specific Solanum tuberosum 4113 Red tea Type 1 Robusta coffee Type 1 specific Coffea canephora 49390 Tea Type 1 specific Camellia sinensis 4442 baked meaty nutty vegetable