Mixture of (R,S)-N-Nitroso Anabasine-d4 + rac N’-Nitrosonornicotine-d4 + 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanone-d4 + (S)-N-Nitroso Anatabine-d4 (0.1mg/mL in Acetonitrile)
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- structure.search.product.name Mixture of (R,S)-N-Nitroso Anabasine-d4 + rac N’-Nitrosonornicotine-d4 + 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanone-d4 + (S)-N-Nitroso Anatabine-d4 (0.1mg/mL in Acetonitrile)
- Product Code: TRC-KIT1867-1X1ML
- Brand: TRC
Product Overview
Product Code
TRC-KIT1867-1X1ML
CAS Number
4 AnalytesProduct Format
Mixture
Matrix
Acetonitrile
Product Categories
Stable isotopes, Impurity Reference Materials , Nitrosamine Reference Materials, Nitrosamine Research and Reference Materials, TRC
Alternate CAS Number
4 AnalytesAnalytical Method
NMR, MS
Documentation
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Product Information
Chemical Data
Analyte Name
Measured Value
CAS Number
Molecular Structure
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(RS)-N-Nitrosoanabasine pyridinyl-d4
0.1 mg/mL
(S)-N-Nitrosoanatabine 2,4,5,6 D4
0.1 mg/mL
N-Nitrosonornicotine 2,4,5,6 D4 (pyridine D4)
0.1 mg/mL
N-Nitrosonornicotine-ketoneD4(pyridylD4)
0.1 mg/mL
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CAS Number
Alternate CAS Number
Unlabelled CAS Number
Molecular Formula
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Molecular Weight
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Accurate Mass
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Melting Point
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Appearance/Form
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SMILES
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InChI
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IUPAC
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(RS)-N-Nitrosoanabasine pyridinyl-d4
CAS Number
Alternate CAS Number
Unlabelled CAS Number
-
Molecular Formula
C10 2H4 H9 N3 O
Molecular Weight
195.25
Accurate Mass
195.131
SMILES
[2H]c1nc([2H])c(C2CCCCN2N=O)c([2H])c1[2H]
InChI
InChI=1S/C10H13N3O/c14-12-13-7-2-1-5-10(13)9-4-3-6-11-8-9/h3-4,6,8,10H,1-2,5,7H2/i3D,4D,6D,8D
IUPAC
2,3,4,6-tetradeuterio-5-(1-nitrosopiperidin-2-yl)pyridine
(S)-N-Nitrosoanatabine 2,4,5,6 D4
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
Molecular Formula
C10 2H4 H7 N3 O
Molecular Weight
193.24
Accurate Mass
193.1153
SMILES
[2H]c1nc([2H])c([C@@H]2CC=CCN2N=O)c([2H])c1[2H]
InChI
InChI=1S/C10H11N3O/c14-12-13-7-2-1-5-10(13)9-4-3-6-11-8-9/h1-4,6,8,10H,5,7H2/t10-/m0/s1/i3D,4D,6D,8D
IUPAC
2,3,4,6-tetradeuterio-5-[(2S)-1-nitroso-3,6-dihydro-2H-pyridin-2-yl]pyridine
N-Nitrosonornicotine 2,4,5,6 D4 (pyridine D4)
CAS Number
Alternate CAS Number
Unlabelled CAS Number
Molecular Formula
C9 2H4 H7 N3 O
Molecular Weight
181.23
Accurate Mass
181.1153
SMILES
[2H]c1nc([2H])c(C2CCCN2N=O)c([2H])c1[2H]
InChI
InChI=1S/C9H11N3O/c13-11-12-6-2-4-9(12)8-3-1-5-10-7-8/h1,3,5,7,9H,2,4,6H2/i1D,3D,5D,7D
IUPAC
2,3,4,6-tetradeuterio-5-(1-nitrosopyrrolidin-2-yl)pyridine
N-Nitrosonornicotine-ketoneD4(pyridylD4)
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
Molecular Formula
C10 2H4 H9 N3 O2
Molecular Weight
211.25
Accurate Mass
211.1259
SMILES
[2H]c1nc([2H])c(C(=O)CCCN(C)N=O)c([2H])c1[2H]
InChI
InChI=1S/C10H13N3O2/c1-13(12-15)7-3-5-10(14)9-4-2-6-11-8-9/h2,4,6,8H,3,5,7H2,1H3/i2D,4D,6D,8D
IUPAC
N-methyl-N-[4-oxo-4-(2,4,5,6-tetradeuteriopyridin-3-yl)butyl]nitrous amide
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Mixture
Matrix
Acetonitrile
Analytical Method
NMR, MS
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