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Product Overview

Product Code

TRC-P191100

CAS Number

52372-86-8

Product Format

Neat

Molecular Formula

C13H16N2O5S

Molecular Weight

312.34

API Family

Acetaminophen

Product Type

Impurity, Metabolite, API

Purity

>95% (HPLC)

Drug Type

Cardiac Drugs

Documentation

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Product Information

Chemical Data

Analyte Name

3-(N-Acetyl-L-cystein-S-yl) Acetaminophen

CAS Number

52372-86-8

Molecular Formula

C13H16N2O5S

Molecular Weight

312.34

Accurate Mass

312.078

SMILES

OC1=C(SC[C@H](NC(C)=O)C(O)=O)C=C(NC(C)=O)C=C1

InChI

InChI=1S/C13H16N2O5S/c1-7(16)14-9-3-4-11(18)12(5-9)21-6-10(13(19)20)15-8(2)17/h3-5,10,18H,6H2,1-2H3,(H,14,16)(H,15,17)(H,19,20)/t10-/m0/s1

Product Data

Storage Temperature

-20°C

Shipping Temperature

Dry Pack

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

API Family

Acetaminophen

Purity

>95% (HPLC)

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