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Product Overview

Product Code

CDN-D-7473

CAS Number

1330180-66-9

Product Format

Neat

Molecular Formula

C17 D3 H14 Cl2 N . Cl H

Molecular Weight

345.709

Product Categories

Nitrogen compounds, Stable isotopes

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

79617-99-5

Purity

99 atom % D, min 98% Chemical Purity

Documentation

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Product Information

Analyte Data

Analyte Name

rac-trans Sertraline-d3 Hydrochloride

CAS Number

1330180-66-9

Molecular Formula

C17 D3 H14 Cl2 N . Cl H

Molecular Weight

345.709

Accurate Mass

344.069

SMILES

Cl.[2H]C([2H])([2H])N[C@@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c3ccccc13

InChI

InChI=1S/C17H17Cl2N.ClH/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11;/h2-6,8,10,12,17,20H,7,9H2,1H3;1H/t12-,17+;/m0./s1/i1D3;

IUPAC

rac-(1R,4S)-4-(3,4-dichlorophenyl)-N-(trideuteriomethyl)-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride

Unlabelled CAS Number

79617-99-5

SIL Type

Deuterium

Product Data

Storage Temperature

Room Temperature

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Purity

99 atom % D, min 98% Chemical Purity

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(±)-trans-Sertraline-d3 HCl (N-methyl-d3)

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