Analyte Name

6-O-Acetyl-hydroxycodeine

Molecular Formula

C20 H23 N O5

Molecular Weight

357.4

Accurate Mass

357.158

SMILES

COc1ccc2C(O)[C@@H]3[C@@H]4C=C[C@H](OC(=O)C)[C@@H]5Oc1c2[C@]45CCN3C

InChI

InChI=1S/C20H23NO5/c1-10(22)25-14-7-5-12-16-17(23)11-4-6-13(24-3)18-15(11)20(12,19(14)26-18)8-9-21(16)2/h4-7,12,14,16-17,19,23H,8-9H2,1-3H3/t12-,14-,16-,17?,19-,20-/m0/s1

IUPAC

[(4S,4aR,7S,7aR,12bS)-13-hydroxy-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl] acetate

Alternate CAS Number

96562-81-1

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat