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Product Overview

Product Code

TRC-A602502

CAS Number

1189890-45-6

Product Format

Neat

Molecular Formula

C10H9D6NO

Molecular Weight

171.27

Unlabelled CAS Number

52846-75-0

Product Information

Analyte Name

rac 4-(3-Aminobutyl)phenol-d6

CAS Number

1189890-45-6

Molecular Formula

C10H9D6NO

Molecular Weight

171.27

Accurate Mass

171.153

SMILES

[2H]C([2H])([2H])C([2H])(N)C([2H])([2H])Cc1ccc(O)cc1

InChI

InChI=1S/C10H15NO/c1-8(11)2-3-9-4-6-10(12)7-5-9/h4-8,12H,2-3,11H2,1H3/i1D3,2D2,8D

IUPAC

4-(3-amino-2,2,3,4,4,4-hexadeuteriobutyl)phenol

Unlabelled CAS Number

52846-75-0

SIL Type

Deuterium

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

A labelled metabolite of the antihypertensive agent, Labetalol (L096500). Ractopamine impurity.

References: Gal, J., et al.: Res. Comm. Chem. Pathol. Pharmacol., 62, 3 (1988),

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