4-[4-(dimethyl-d6-amino)-1-(4-fluorophenyl)-1-buten-1-yl]-3-(hydroxymethyl)-benzonitrile (Citalopram Olefinic Impurity)

Analyte Name

4-[4-(dimethyl-d6-amino)-1-(4-fluorophenyl)-1-buten-1-yl]-3-(hydroxymethyl)-benzonitrile (Citalopram Olefinic Impurity)

Molecular Formula

C20 D6 H15 F N2 O

Molecular Weight

330.429

Accurate Mass

330.201

SMILES

[2H]C([2H])([2H])N(CC\C=C(\c1ccc(F)cc1)/c2ccc(cc2CO)C#N)C([2H])([2H])[2H]

InChI

InChI=1S/C20H21FN2O/c1-23(2)11-3-4-19(16-6-8-18(21)9-7-16)20-10-5-15(13-22)12-17(20)14-24/h4-10,12,24H,3,11,14H2,1-2H3/b19-4-/i1D3,2D3

IUPAC

4-[(Z)-4-[bis(trideuteriomethyl)amino]-1-(4-fluorophenyl)but-1-enyl]-3-(hydroxymethyl)benzonitrile

Unlabelled CAS Number

920282-75-3

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat