(S)-4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol
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- structure.search.product.name (S)-4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol
- Product Code: TRC-M323790
- CAS Number: 197712-01-9
- Brand: TRC
Product Overview
Product Code
TRC-M323790
CAS Number
Product Format
Neat
Molecular Formula
C10 H15 N3 O2
Molecular Weight
209.245
Product Categories
Reference Materials for Smoking-Related Substances , Carcinogens, TRC
Product Type
MetaboliteAlternate CAS Number
Documentation
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Product Information
Chemical Data
Analyte Name
(S)-4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol
CAS Number
197712-01-9
Molecular Formula
C10 H15 N3 O2
Molecular Weight
209.245
Accurate Mass
209.1164
SMILES
CN(CCC[C@H](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/t10-/m0/s1
IUPAC
N-[(4S)-4-hydroxy-4-(3-pyridyl)butyl]-N-methyl-nitrous amide
Alternate CAS Number
(R)-enantiomer: 197711-99-2
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Metabolite
Product Format
Neat