6-(1-Methylpropyl)-3-(2-Methylpropyl)Pyrazin-2(1H)-One
[CAS# 21641-71-4]

Identification

• Name: 6-(1-Methylpropyl)-3-(2-Methylpropyl)Pyrazin-2(1H)-One
• Synonyms: 3-Isobutyl-6-Sec-Butyl-1H-Pyrazin-2-One; Deoxyaspergillic Acid; Nci60_000622
• Molecular Formula: C₁₂H₂₀N₂O
• Molecular Weight: 208.30
• CAS Registry Number: 21641-71-4
• SMILES: C(C1=NC=C(NC1=O)C(C)CC)C(C)C
• InChI: 1S/C12H20N2O/c1-5-9(4)11-7-13-10(6-8(2)3)12(15)14-11/h7-9H,5-6H2,1-4H3,(H,14,15)
• InChIKey: NQUCTITVLHEDIU-UHFFFAOYSA-N

Properties

• Density: 1.039g/cm³ (Cal.)