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Product Overview

Product Code

TRC-C725050

CAS Number

147732-31-8

Product Format

Neat

Molecular Formula

C10 H12 N2 O

Molecular Weight

176.22

API Family

Nicotine

Product Categories

TRC, API Reference Standards & Research Materials

Product Type

API

Documentation

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Product Information

Chemical Data

Analyte Name

(R,S)-ortho-Cotinine

CAS Number

147732-31-8

Molecular Formula

C10 H12 N2 O

Molecular Weight

176.22

Accurate Mass

176.095

SMILES

CN1C(CCC1=O)c2ccccn2

InChI

InChI=1S/C10H12N2O/c1-12-9(5-6-10(12)13)8-4-2-3-7-11-8/h2-4,7,9H,5-6H2,1H3

IUPAC

1-methyl-5-pyridin-2-ylpyrrolidin-2-one

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Nicotine

Product Description

A metabolite of Nicotine in humans. Used for internal standardization for routine biomonitoring of nicotine metabolites.

References: Sugasawa, S., et al.: Pharma. Bull., et al.: 2, 39 (1954), Thompson, J.A., et al.: J. Chromatog., 231, 53 (1982); Seeman, J.I., et al.: J. Org. Chem., 51, 1548 (1986)

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(+/-)-ortho-Cotinine

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