Thebaine-N-(methyl-d3) (1mg/ml in Acetonitrile)

Analyte Name

Thebaine-N-methyl-d3

CAS Number

782491-54-7

Molecular Formula

C19 2H3 H18 N O3

Molecular Weight

314.393

Measured Value

1 mg/mL

Accurate Mass

314.171

SMILES

[2H]C([2H])([2H])N1CC[C@]23[C@H]4Oc5c(OC)ccc(C[C@@H]1C2=CC=C4OC)c35

InChI

InChI=1S/C19H21NO3/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/h4-7,13,18H,8-10H2,1-3H3/t13-,18+,19+/m1/s1/i1D3

IUPAC

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

Alternate CAS Number

115-37-7

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Single Solution

Matrix

Acetonitrile