4-(Methyl-d3-nitrosamino)-1-(3-pyridyl)-1-butanol
Product Code
TRC-M325742
CAS Number
Product Format
Neat
Molecular Formula
C10 2H3 H12 N3 O2
Molecular Weight
212.26
API Family
NNALProduct Categories
TRC, Reference Materials for Smoking-Related Substances , Nitrosamine Research and Reference Materials, Nitrosamine Reference Materials , Stable isotopes, Stable Isotope Labelled Analytical Standards
Unlabelled CAS Number
Documentation
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Product Information
Chemical Data
Analyte Name
4-(Methyl-d3-nitrosamino)-1-(3-pyridyl)-1-butanol
CAS Number
1020719-61-2
Molecular Formula
C10 2H3 H12 N3 O2
Molecular Weight
212.26
Accurate Mass
212.1353
SMILES
[2H]C([2H])([2H])N(CCCC(O)c1cccnc1)N=O
InChI
InChI=1S/C10H15N3O2/c1-13(12-15)7-3-5-10(14)9-4-2-6-11-8-9/h2,4,6,8,10,14H,3,5,7H2,1H3/i1D3
IUPAC
N-(4-hydroxy-4-pyridin-3-ylbutyl)-N-(trideuteriomethyl)nitrous amide
Unlabelled CAS Number
76014-81-8
SIL Type
Deuterium
Product Data
Storage Temperature
+4°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Metabolite; Stable Isotope Labelled
Product Format
Neat
API Family
Product Description
A deuterated metabolite of NNK (Cat. #M325750), a tobacco-specific nitrosamine.
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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