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Product Overview

Product Code

TRC-H953005

CAS Number

359435-75-9

Product Format

Neat

Molecular Formula

C9 2H4 H7 N O2

Molecular Weight

169.21

Product Categories

TRC, Reference Materials for Smoking-Related Substances , Stable isotopes, Stable Isotope Labelled Analytical Standards

Product Type

Stable Isotope Labelled, Metabolite

Unlabelled CAS Number

59578-62-0

Documentation

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Product Information

Chemical Data

Analyte Name

4-Hydroxy-1-(3-pyridyl)-1-butanone (3,3,4,4-D4)

CAS Number

359435-75-9

Molecular Formula

C9 2H4 H7 N O2

Molecular Weight

169.21

Accurate Mass

169.1041

SMILES

[2H]C([2H])(O)C([2H])([2H])CC(=O)c1cccnc1

InChI

InChI=1S/C9H11NO2/c11-6-2-4-9(12)8-3-1-5-10-7-8/h1,3,5,7,11H,2,4,6H2/i2D2,6D2

IUPAC

3,3,4,4-tetradeuterio-4-hydroxy-1-pyridin-3-ylbutan-1-one

Unlabelled CAS Number

59578-62-0

SIL Type

Deuterium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite; Stable Isotope Labelled

Product Format

Neat

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Chemical Data

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4-Hydroxy-1-(3-pyridyl)-1-butanone (3,3,4,4-D4)

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