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Product Overview

Product Code

TRC-C080202

Product Format

Neat

Molecular Formula

C7H3D9N4O

Molecular Weight

177.25

Product Categories

TRC

Alternate CAS Number

20041-90-1

Unlabelled CAS Number

20041-90-1

Product Information

Analyte Name

Caffeidine-d9

Molecular Formula

C7H3D9N4O

Molecular Weight

177.25

Accurate Mass

177.16

SMILES

O=C(C1=C(NC([2H])([2H])[2H])N=CN1C([2H])([2H])[2H])NC([2H])([2H])[2H]

InChI

InChI=1S/C7H12N4O/c1-8-6-5(7(12)9-2)11(3)4-10-6/h4,8H,1-3H3,(H,9,12)/i1D3,2D3,3D3

IUPAC

N,1-bis(Methyl-d3)-4-((methyl-d3)amino)-1H-imidazole-5-carboxamid

Alternate CAS Number

20041-90-1

Unlabelled CAS Number

20041-90-1

SIL Type

Deuterium

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

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