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1020719-68-9

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1020719-68-9 Structure

1020719-68-9 Structure
IdentificationBack Directory
[Name]

(R,S)-N-NITROSOANABASINE-D4
[CAS]

1020719-68-9
[Synonyms]

NAB-d4
NABETA-D4
(R,S)-N-NITROSOANABASINE-D4
5-(1-Nitroso-2-piperidinyl)pyridine-2,3,4,6-d4
(R,S)-N-Nitroso Anabasine-d4 (0.1 Mg/ML in Methanol)
5-(1-Nitroso-2-piperidinyl)pyridine-2,3,4,6-d4
[Molecular Formula]

C10H9D4N3O
[MDL Number]

MFCD07369613
[MOL File]

1020719-68-9.mol
[Molecular Weight]

195.25
Chemical PropertiesBack Directory
[Appearance]

Yellow Oil
[storage temp. ]

Refrigerator
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Oil to Low-Melting Solid
[color ]

Colourless to Orange
[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
[InChIKey]

BXYPVKMROLGXJI-AJEVBKBKSA-N
[SMILES]

N(N1CCCCC1C1=C([2H])N=C([2H])C([2H])=C1[2H])=O
Hazard InformationBack Directory
[Chemical Properties]

Yellow Oil
[Uses]

A labelled metabolite of tobacco, a specific N-nitrosamines.
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Danger
[Hazard statements ]

H301
[Precautionary statements ]

P264-P270-P301+P310-P321-P330-P405-P501
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