Analyte Name

Codeine-13C4,15N

CAS Number

2483830-41-5

Molecular Formula

13C4 C14 H21 15N O3

Molecular Weight

305.33

Accurate Mass

304.16

SMILES

COc1ccc2[13CH2][13C@@H]3[C@@H]4C=C[C@H](O)[C@H]5Oc1c2[C@]45[13CH2][13CH2][15N]3C

InChI

InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-13,17,20H,7-9H2,1-2H3/t11-,12+,13-,17+,18-/m0/s1/i7+1,8+1,9+1,12+1,19+1

IUPAC

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

SIL Type

Carbon, Nitrogen

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat