Analyte Name

Labetalol Cyclohexyl Analog-D4

Molecular Formula

C19 D4 H26 N2 O3 . H Cl

Molecular Weight

374.939

Accurate Mass

374.227

SMILES

Cl.[2H]C([2H])([2H])C([2H])(CCC1CCCCC1)NCC(O)c2ccc(O)c(c2)C(=O)N

InChI

InChI=1S/C19H30N2O3.ClH/c1-13(7-8-14-5-3-2-4-6-14)21-12-18(23)15-9-10-17(22)16(11-15)19(20)24;/h9-11,13-14,18,21-23H,2-8,12H2,1H3,(H2,20,24);1H/i1D3,13D;

IUPAC

5-[2-[(4-cyclohexyl-1,1,1,2-tetradeuteriobutan-2-yl)amino]-1-hydroxyethyl]-2-hydroxybenzamide;hydrochloride

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat