4-(N-Nitroso-N-methylamino)-1-(3-pyridyl)-1-butanone
- Formula: C10H13N3O2
- Molecular weight: 207.2291
- IUPAC Standard 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
- IUPAC Standard InChIKey: FLAQQSHRLBFIEZ-UHFFFAOYSA-N
- CAS Registry Number: 64091-91-4
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: NNK; 4-(N-Methyl-N-nitrosamino)-1-(3-pyridyl)-1-butanone; 1-Butanone, 4-(N-methyl-N-nitrosamino)-1-(3-pyridyl); Ketone, 3-pyridyl 3-(N-methyl-N-nitrosamino)propyl; 4-(Methyl-N-nitrosamino)-1-(3-pyridyl)-1-butanone; N-Methyl-N-nitroso-4-oxo-4-(3-pyridyl)butyl amine
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Gas Chromatography
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Normal alkane RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-5 | 1935. | Andersen, Fleming, et al., 1989 | He, 60. C @ 1. min, 4. K/min, 260. C @ 5. min; Column length: 30. m; Column diameter: 0.25 mm |
References
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Andersen, Fleming, et al., 1989
Andersen, R.A.; Fleming, P.D.; Burton, H.R.; Hamilton-Kemp, T.R.; Sutton, T.G.,
N'-Acyl and N'-nitroso pyridine alkaloids in alkaloid lines of burley tobacco during growth and air-curing,
J. Agric. Food Chem., 1989, 37, 1, 44-50, https://doi.org/10.1021/jf00085a011
. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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