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Product Overview

Product Code

TRC-H962027

Product Format

Neat

Molecular Formula

C19 D6 H16 N O4 S2

Molecular Weight

398.549

Unlabelled CAS Number

136431-94-2

Documentation

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Product Information

Analyte Name

7-[(Hydroxy-2-thienyl-3-thienylacetyl)oxy]-9,9-dimethyl-3-Oxa-9-azoniatricyclo[3.3.1.02,4]nonane Bromide-d6

Molecular Formula

C19 D6 H16 N O4 S2

Molecular Weight

398.549

Accurate Mass

398.136

SMILES

[2H]C([2H])([2H])[N+]1([C@@H]2C[C@H](C[C@H]1C3O[C@H]23)OC(=O)C(O)(c4ccsc4)c5cccs5)C([2H])([2H])[2H]

InChI

InChI=1S/C19H22NO4S2/c1-20(2)13-8-12(9-14(20)17-16(13)24-17)23-18(21)19(22,11-5-7-25-10-11)15-4-3-6-26-15/h3-7,10,12-14,16-17,22H,8-9H2,1-2H3/q+1/t12-,13-,14+,16-,17?,19?/m1/s1/i1D3,2D3

IUPAC

[(1S,4R,5R)-9,9-bis(trideuteriomethyl)-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl] 2-hydroxy-2-thiophen-2-yl-2-thiophen-3-ylacetate

Unlabelled CAS Number

136431-94-2

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

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