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Product Overview

Product Code

TRC-E934110

Product Format

Neat

Molecular Formula

C18 H15 Cl N2 O4 S

Molecular Weight

390.841

Product Categories

TRC, Impurity Reference Materials

Documentation

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Product Information

Chemical Data

Analyte Name

Etoricoxib N-1,1’-Dioxide

Molecular Formula

C18 H15 Cl N2 O4 S

Molecular Weight

390.841

Accurate Mass

390.044

SMILES

Cc1ccc(c[n+]1[O-])c2c(cc(Cl)c[n+]2[O-])c3ccc(cc3)S(=O)(=O)C

InChI

InChI=1S/C18H15ClN2O4S/c1-12-3-4-14(10-20(12)22)18-17(9-15(19)11-21(18)23)13-5-7-16(8-6-13)26(2,24)25/h3-11H,1-2H3

IUPAC

5-chloro-2-(6-methyl-1-oxidopyridin-1-ium-3-yl)-3-(4-methylsulfonylphenyl)-1-oxidopyridin-1-ium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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