Fingolimod-d4 Hydrochloride

Analyte Name

Fingolimod-d4 Hydrochloride

CAS Number

1346604-90-7

Molecular Formula

C19H30D4ClNO2

Molecular Weight

347.96

Accurate Mass

347.25

SMILES

C(CC(C(O)([2H])[2H])(C(O)([2H])[2H])N)C1=CC=C(CCCCCCCC)C=C1.Cl

InChI

InChI=1S/C19H33NO2.ClH/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)13-14-19(20,15-21)16-22;/h9-12,21-22H,2-8,13-16,20H2,1H3;1H/i15D2,16D2;

IUPAC

2-amino-2-(4-octylphenethyl)propane-1,1,3,3-d4-1,3-diol hydrochloride

Unlabelled CAS Number

162359-56-0

SIL Type

Deuterium

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity; Stable Isotope Labelled

Product Format

Neat

API Family

Fingolimod

Purity

>95% (HPLC)