6-O-Methyl Codeine (1mg/ml in Acetonitrile)

Analyte Name

O-Methylcodeine

CAS Number

2859-16-7

Molecular Formula

C19 H23 N O3

Molecular Weight

313.39

Concentration

1 mg/mL

Accurate Mass

313.1678

SMILES

CO[C@H]1C=C[C@H]2[C@H]3Cc4ccc(OC)c5O[C@@H]1[C@]2(CCN3C)c45

InChI

InChI=1S/C19H23NO3/c1-20-9-8-19-12-5-7-15(22-3)18(19)23-17-14(21-2)6-4-11(16(17)19)10-13(12)20/h4-7,12-13,15,18H,8-10H2,1-3H3/t12-,13+,15-,18-,19-/m0/s1

IUPAC

(4R,4aR,7S,7aR,12bS)-7,9-dimethoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline

Country of Origin

CANADA

Product Format

Single Solution

Matrix

Acetonitrile