Analyte Name

rac Pregabalin-13C3

CAS Number

1189980-48-0

Molecular Formula

13C3 C5 H17 N O2

Molecular Weight

162.20

Accurate Mass

162.136

SMILES

CC(C)CC([13CH2]N)[13CH2][13C](=O)O

InChI

InChI=1S/C8H17NO2/c1-6(2)3-7(5-9)4-8(10)11/h6-7H,3-5,9H2,1-2H3,(H,10,11)/i4+1,5+1,8+1

IUPAC

3-(amino(1^{13}C)methyl)-5-methyl(1,2-^{13}C_{2})hexanoic acid

Unlabelled CAS Number

128013-69-4

SIL Type

Carbon

Storage Temperature

-20°C

Shipping Temperature

Ice pack (-20°C)

Country of Origin

UNITED STATES

Tariff Code

38220000

Product Format

Single Solution