Analyte Name

Mepyramine Theophyllinacetate

CAS Number

57383-74-1

Molecular Formula

C17 H23 N3 O . C9 H10 N4 O4

Molecular Weight

523.584

Accurate Mass

523.254

SMILES

COc1ccc(CN(CCN(C)C)c2ccccn2)cc1.CN3C(=O)N(C)c4ncn(CC(=O)O)c4C3=O

InChI

InChI=1S/C17H23N3O.C9H10N4O4/c1-19(2)12-13-20(17-6-4-5-11-18-17)14-15-7-9-16(21-3)10-8-15;1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h4-11H,12-14H2,1-3H3;4H,3H2,1-2H3,(H,14,15)

IUPAC

2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid;N'-[(4-methoxyphenyl)methyl]-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamine

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat