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Product Overview

Product Code

TLCS-2047

Molecular Formula

C20 H19 F6 N5 O5

Molecular Weight

523.38

Product Categories

Laboratory Consumables Reference Materials

Product Information

Analyte Data

Analyte Name

Sitagliptin fumarate adduct

Molecular Formula

C20 H19 F6 N5 O5

Molecular Weight

523.38

Accurate Mass

523.129

SMILES

OC(=O)CC(N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc3cc(F)c(F)cc3F)C(=O)O

InChI

InChI=1S/C20H19F6N5O5/c21-11-6-13(23)12(22)4-9(11)3-10(27-14(18(35)36)7-17(33)34)5-16(32)30-1-2-31-15(8-30)28-29-19(31)20(24,25)26/h4,6,10,14,27H,1-3,5,7-8H2,(H,33,34)(H,35,36)/t10-,14?/m1/s1

Product Data

Country of Origin

CANADA

Tariff Code

29339980

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