1.0 2010-04-08 22:11:36 UTC 2019-11-26 03:11:07 UTC FDB015028 2-Methyl-3-(2-methylpropyl)pyrazine Present in seed oils of red pepper and pumpkinand is) also present in coffee aroma and baked or chipped potatoes. Flavouring ingredient. 2-Methyl-3-(2-methylpropyl)pyrazine is found in coffee and coffee products, root vegetables, and potato. 2-Isobutyl-3-methyl-pyrazine 2-Isobutyl-3-methylpyrazine 2-Isobutyl-3-methylpyrazine, 8CI 2-Methyl-3-(2-methylpropyl)-pyrazine 2-Methyl-3-isobutylpyrazine 3-Methyl-2-isobutyl pyrazine FEMA 3133 Pyrazine, 2-isobutyl-3-methyl- Pyrazine, 2-methyl-3-(2-methylpropyl)- C9H14N2 150.2209 150.115698458 2-methyl-3-(2-methylpropyl)pyrazine 2-methyl-3-(2-methylpropyl)pyrazine 13925-06-9 CC(C)CC1=C(C)N=CC=N1 InChI=1S/C9H14N2/c1-7(2)6-9-8(3)10-4-5-11-9/h4-5,7H,6H2,1-3H3 ZHMIODDNZRIENW-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 2.04 ALOGPS logs -1.14 ALOGPS solubility 1.10e+01 g/l ALOGPS logp 1.23 ChemAxon pka_strongest_basic 1.48 ChemAxon iupac 2-methyl-3-(2-methylpropyl)pyrazine ChemAxon average_mass 150.2209 ChemAxon mono_mass 150.115698458 ChemAxon smiles CC(C)CC1=C(C)N=CC=N1 ChemAxon formula C9H14N2 ChemAxon inchi InChI=1S/C9H14N2/c1-7(2)6-9-8(3)10-4-5-11-9/h4-5,7H,6H2,1-3H3 ChemAxon inchikey ZHMIODDNZRIENW-UHFFFAOYSA-N ChemAxon polar_surface_area 25.78 ChemAxon refractivity 44.7 ChemAxon polarizability 17.49 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::EiMs 1730 Specdb::CMs 24884 Specdb::CMs 151955 Specdb::MsMs 47307 Specdb::MsMs 47308 Specdb::MsMs 47309 Specdb::MsMs 149970 Specdb::MsMs 149971 Specdb::MsMs 149972 Specdb::MsMs 2337637 Specdb::MsMs 2337638 Specdb::MsMs 2337639 Specdb::MsMs 2624324 Specdb::MsMs 2624325 Specdb::MsMs 2624326 Specdb::MsIr 7146 Specdb::MsIr 7147 Specdb::NmrOneD 3833 Specdb::NmrOneD 4100 Specdb::NmrOneD 134138 Specdb::NmrOneD 134139 Specdb::NmrOneD 134140 Specdb::NmrOneD 134141 Specdb::NmrOneD 134142 Specdb::NmrOneD 134143 Specdb::NmrOneD 134144 Specdb::NmrOneD 134145 Specdb::NmrOneD 134146 Specdb::NmrOneD 134147 Specdb::NmrOneD 134148 Specdb::NmrOneD 134149 Specdb::NmrOneD 134150 Specdb::NmrOneD 134151 Specdb::NmrOneD 134152 Specdb::NmrOneD 134153 Specdb::NmrOneD 134154 Specdb::NmrOneD 134155 Specdb::NmrOneD 134156 Specdb::NmrOneD 134157 HMDB36174 #<Reference:0x000055ce33639ff0> Arabica coffee Type 1 specific Coffea arabica 13443 Coffee and coffee products Unknown generic Potato Type 1 specific Solanum tuberosum 4113 Robusta coffee Type 1 specific Coffea canephora 49390 Root vegetables Unknown generic green herbal sugar syrup