Product Code

TRC-N529050

CAS Number

51938-17-1

Product Format

Neat

Molecular Formula

C6 H12 N2 O3

Molecular Weight

160.17

Product Categories

TRC, Nicotine and related compounds, Dipeptides, Nitrosamine Reference Materials, Impurity Reference Materials , Nitrosamine Research and Reference Materials

Product Type

Contaminant

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

N-Nitroso-N-methyl-4-aminobutyric Acid, Methyl Ester

CAS Number

51938-17-1

Molecular Formula

C6 H12 N2 O3

Molecular Weight

160.17

Accurate Mass

160.0848

SMILES

COC(=O)CCCN(C)N=O

InChI

InChI=1S/C6H12N2O3/c1-8(7-10)5-3-4-6(9)11-2/h3-5H2,1-2H3

IUPAC

methyl 4-[methyl(nitroso)amino]butanoate

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Product Description

The methyl ester of the nitrosamino acid, N-Nitroso-N-methylaminobutyric acid. This N-nitrosamino acid has been isolated and identified in various types of tobacco, including snuff, chewing and pipe tobacco, cigars and cigarettes.

References: Suzuki, E., et al.: Chem. Pharm. Bull., 28, 1612 (1980), Ohshima, H, et al.: Cancer Letters, 26, 153 (1985).

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N-Nitroso-N-methyl-4-aminobutyric Acid Methyl Ester

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