Analyte Name

N-Demethyl Alogliptin-2,2,2-trifluoroacetate

CAS Number

1262205-67-3

Molecular Formula

C19H20F3N5O4

Molecular Weight

439.4

Accurate Mass

439.15

SMILES

OC(C(F)(F)F)=O.O=C(NC1=O)C=C(N2C[C@@H](CCC2)N)N1CC3=C(C=CC=C3)C#N

InChI

InChI=1S/C17H19N5O2.C2HF3O2/c18-9-12-4-1-2-5-13(12)10-22-16(8-15(23)20-17(22)24)21-7-3-6-14(19)11-21;3-2(4,5)1(6)7/h1-2,4-5,8,14H,3,6-7,10-11,19H2,(H,20,23,24);(H,6,7)/t14-;/m1./s1

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat