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Product Overview

Product Code

TRC-N123900

CAS Number

3006789-98-3

Product Format

Neat

Molecular Formula

C17H16Cl2N2O

Molecular Weight

335.23

API Family

Sertraline

Product Categories

TRC, Nitrosamine Reference Materials, Impurity Reference Materials , Nitrosamine Research and Reference Materials

Product Type

Impurity

Purity

>95% (HPLC)

Documentation

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Product Information

Chemical Data

Analyte Name

N-Nitroso Sertraline

CAS Number

3006789-98-3

Molecular Formula

C17H16Cl2N2O

Molecular Weight

335.23

Accurate Mass

334.064

SMILES

ClC(C(Cl)=C1)=CC=C1[C@H]2C3=C(C=CC=C3)[C@@H](N(N=O)C)CC2

InChI

InChI=1S/C17H16Cl2N2O/c1-21(20-22)17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11/h2-6,8,10,12,17H,7,9H2,1H3/t12-,17-/m0/s1

IUPAC

N-[(1S,4S)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]-N-methylnitrous amide

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Sertraline

Purity

>95% (HPLC)

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