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Product Overview

Product Code

TRC-T444852

CAS Number

1127226-56-5

Product Format

Neat

Molecular Formula

C19 D3 H19 N O4 S2 . Br

Molecular Weight

475.435

API Family

Tiotropium Bromide, Tiotropium

Product Categories

TRC, Enzyme inhibitors, Enzyme agonists & antagonists, API Reference Standards & Research Materials, Acetylcholine Receptors, Neurotransmission, Memory, Learning and Cognition, Parkinson's, Schizophrenia, Pain and Inflammation, Stable isotopes, Stable Isotope Labelled Analytical Standards, Pharmaceutical Toxicology Reference Materials

Product Type

Stable Isotope Labelled, API

Alternate CAS Number

1352567-52-2

Unlabelled CAS Number

136310-93-5

Documentation

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Product Information

Chemical Data

Analyte Name

Tiotropium N-methyl-d3 bromide

CAS Number

1127226-56-5

Molecular Formula

C19 D3 H19 N O4 S2 . Br

Molecular Weight

475.435

Accurate Mass

474.036

SMILES

[Br-].[2H]C([2H])([2H])[N+]1(C)[C@@H]2C[C@H](C[C@H]1[C@@H]3O[C@H]23)OC(=O)C(O)(c4cccs4)c5cccs5

InChI

InChI=1S/C19H22NO4S2.BrH/c1-20(2)12-9-11(10-13(20)17-16(12)24-17)23-18(21)19(22,14-5-3-7-25-14)15-6-4-8-26-15;/h3-8,11-13,16-17,22H,9-10H2,1-2H3;1H/q+1;/p-1/t11-,12-,13+,16-,17+;/i1D3;/t11-,12-,13+,16-,17+,20?;

IUPAC

[(1R,2R,4S,5S)-9-methyl-9-(trideuteriomethyl)-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl] 2-hydroxy-2,2-bis(2-thienyl)acetate bromide

Alternate CAS Number

1352567-52-2

Unlabelled CAS Number

136310-93-5

SIL Type

Deuterium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API

Product Format

Neat

API Family

Tiotropium Bromide; Tiotropium

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Product Overview

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Tiotropium-d3 Bromide

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