Product Code

TRC-M304642

Product Format

Neat

Molecular Formula

C18H18D3N3O3S

Molecular Weight

362.46

Product Categories

TRC, Stable isotopes, Impurity Reference Materials , Pharmaceutical Toxicology Reference Materials

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

1346240-11-6

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Product Information

Chemical Data

Analyte Name

N-Methyl Esomeprazole-d3(Mixture of isomers with the methylated nitrogens of imidazole)

Molecular Formula

C18H18D3N3O3S

Molecular Weight

362.46

Accurate Mass

362.15

SMILES

O=[S@@](CC1=C(C)C(OC)=C(C)C=N1)C(N2C([2H])([2H])[2H])=NC3=C2C=CC(OC)=C3.O=[S@@](CC4=C(C)C(OC)=C(C)C=N4)C5=NC6=C(N5C([2H])([2H])[2H])C=C(OC)C=C6

InChI

InChI=1S/2C18H21N3O3S/c1-11-9-19-15(12(2)17(11)24-5)10-25(22)18-20-14-8-13(23-4)6-7-16(14)21(18)3;1-11-9-19-15(12(2)17(11)24-5)10-25(22)18-20-14-7-6-13(23-4)8-16(14)21(18)3/h2*6-9H,10H2,1-5H3/t2*25-/m00/s1/i2*3D3

Unlabelled CAS Number

1346240-11-6

SIL Type

Deuterium

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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N-Methyl Esomeprazole-d3(Mixture of isomers with the methylated nitrogens of imidazole)

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