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Product Code

TRC-O860000

CAS Number

109065-57-8

Product Format

Neat

Molecular Formula

C11 H13 N O3

Molecular Weight

207.23

Product Categories

TRC

Price and availability

48-hour USA dispatch time
Freight restricted.

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Product Information

Chemical Data

Analyte Name

2-[3-Oxo-3-(3-pyridyl)propyl]-1,3-dioxolane

CAS Number

109065-57-8

Molecular Formula

C11 H13 N O3

Molecular Weight

207.23

Accurate Mass

207.0895

SMILES

O=C(CCC1OCCO1)c2cccnc2

InChI

InChI=1S/C11H13NO3/c13-10(9-2-1-5-12-8-9)3-4-11-14-6-7-15-11/h1-2,5,8,11H,3-4,6-7H2

IUPAC

3-(1,3-dioxolan-2-yl)-1-pyridin-3-ylpropan-1-one

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Product Description

A precursor of 4-Oxo-4-(3-pyridyl) butanal, a metabolite of the tobacco-specific nitrosamine, NNK (Cat. #M32575). Compound requires removal of protecting group.

References: Hecht, S.S., et al.: Cancer Res., 40, 4144 (1980); Kutzer, C., et al.: J. Chromatog. Sci., 35, 1 (1997)

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