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Product Overview

Product Code

TRC-E325552

CAS Number

115144-41-7

Product Format

Neat

Molecular Formula

C9 2H3 H12 N O3 . Cl H

Molecular Weight

224.70

API Family

Cocaine, Cocaine Hydrochloride

Product Categories

TRC, Neurochemical Analytical Standards, Impurity Reference Materials , Additional Neuro Products, Stable isotopes, Stable Isotope Labelled Analytical Standards, Reference Materials for Cocaine and Related Substances

Product Type

Stable Isotope Labelled, Metabolite

Unlabelled CAS Number

5796-31-6

Documentation

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Product Information

Chemical Data

Analyte Name

Ecgonine-D3 HCl

CAS Number

115144-41-7

Molecular Formula

C9 2H3 H12 N O3 . Cl H

Molecular Weight

224.70

Accurate Mass

224.1007

SMILES

Cl.[2H]C([2H])([2H])N1[C@H]2CC[C@@H]1[C@H]([C@@H](O)C2)C(=O)O

InChI

InChI=1S/C9H15NO3.ClH/c1-10-5-2-3-6(10)8(9(12)13)7(11)4-5;/h5-8,11H,2-4H2,1H3,(H,12,13);1H/t5-,6+,7-,8+;/m0./s1/i1D3;

IUPAC

(1S,3S,4R,5R)-3-hydroxy-8-(trideuteriomethyl)-8-azabicyclo[3.2.1]octane-4-carboxylic acid;hydrochloride

Unlabelled CAS Number

5796-31-6

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

API Family

Cocaine; Cocaine Hydrochloride

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Product Overview

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Chemical Data

Product Data

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(-)-Ecgonine-d3 Hydrochloride

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