Name: Benzethonium-d7 Chloride
Brand: TRC
SKU: TRC-B190252

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Product Overview

Product Code

TRC-B190252

Product Format

Neat

Molecular Formula

C27 D7 H35 N O2 . Cl

Molecular Weight

455.124

Product Categories

TRC, Stable isotopes, Pharmaceutical Toxicology Reference Materials , API Reference Standards & Research Materials

Product Type

Stable Isotope Labelled, API

Documentation

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Product Information

Analyte Name

Benzethonium-d7 Chloride

Molecular Formula

C27 D7 H35 N O2 . Cl

Molecular Weight

455.124

Accurate Mass

454.334

SMILES

[Cl-].[2H]c1c([2H])c([2H])c(c([2H])c1[2H])C([2H])([2H])[N+](C)(C)CCOCCOc2ccc(cc2)C(C)(C)CC(C)(C)C

InChI

InChI=1S/C27H42NO2.ClH/c1-26(2,3)22-27(4,5)24-13-15-25(16-14-24)30-20-19-29-18-17-28(6,7)21-23-11-9-8-10-12-23;/h8-16H,17-22H2,1-7H3;1H/q+1;/p-1/i8D,9D,10D,11D,12D,21D2;

IUPAC

[dideuterio-(2,3,4,5,6-pentadeuteriophenyl)methyl]-dimethyl-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azanium;chloride

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled; API

Product Format

Neat

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