Abstract
A method is proposed for the group identification of poorly studied highly toxic O-alkyl alkylphosphonothionofluoridates by electron ionization mass spectra. The method is based on the use of generalized spectral images of four taxonomic groups of this class, subjected to control under the Chemical Weapon Convention. The generalized spectral images were obtained by analyzing the revealed regularities of the fragmentation of these compounds. An advantage of the proposed method is that the assignment of a test substance to one of the class groups and to a class as a whole is a rapid automated standard procedure used in the NIST information retrieval system.
Similar content being viewed by others
REFERENCES
Convention on the Prohibition of the Development, Production, Stockpiling and Use of Chemical Weapons and on Their Destruction, GE 92-61926, Paris, 1993.
Ellison, D.H., Handbook of Chemical and Biological Warfare Agents, Taylor & Francis, 2008.
OPCW Central Analytical Database, e-OCAD ver.16, Technical Secretariat of the Organization for the Prohibition of Chemical Weapons, 2014.
Lebedev, A.T., Lebedev, K.S., Myasoedov, B.F., Rybal’chenko, I.V., Sigeikin, G.I., and Suvorkin, V.N., Mass-Spektrom., 2006, vol. 3, no. 4, p. 277.
NIST/EPA/NIH, NIST Mass Spectral Library, Natl. Inst. Standards Technol., US Secretary of Commerce, 2014.
Morozik, Yu.I., Dudkin, A.V., Tkachuk, Yu.V., Rybal’chenko, I.V., and Khatymov, R.V., J. Anal. Chem., 2016, vol. 71, no. 14, p. 1319.
Morozik, Yu.I., Kuchinskii, E.V., Galyaev, G.V., and Smirnov, A.O., J. Anal. Chem., 2013, vol. 68, no. 8, p. 680.
Galyaev, G.V., Morozik, Yu.I., and Smirnov, A.O., Russ. J. Gen. Chem., 2010, vol. 80, no. 8, p. 1593.
Identification of Potential Organophosphorus Warfare Agents: An Approach for the Standardization of Techniques and Reference Data, Helsinki: The Ministry for Foreign Affairs of Finnland, 1979.
Kireev, A.F., Rybal’chenko, I.V., Suvorkin, V.N., Tipukhov, V.N., and Khamidi, B.A., J. Anal. Chem., 2002, vol. 57, no. 8, p. 708.
Kireev, A.F., Rybal’chenko, I.V., Savchuk, V.I., Suvorkin, V.N., and Kholstov, V.I., J. Anal. Chem., 2000, vol. 55, no. 9, p. 837.
Lebedev, A.T., Morozik, Yu.I., Myasoedov, B.F., Rybal’chenko, I.V., and Fomenko, P.V., Mass-Spektrom., 2007, vol. 4, no. 4, p. 255.
Karni, M. and Mandelbaum, A., Org. Mass Spectrom., 1980, vol. 15, pp. 53.
Lebedev, A.T., Mass-spektrometriya v organicheskoi khimii (Mass Spectrometry in Organic Chemistry), Moscow: BINOM, 2003.
Vul’fson, N.S., Zaikin, V.G., and Mikaya, A.I., Mass-spektrometriya organicheskikh soedinenii (Mass Spectrometry of Organic Compounds), Moscow: Khimiya, 1986.
Budzikiewicz, H., Djerassi, C., and Williams, D.H., Mass Spectrometry of Organic Compounds, San Francisco: Holden-Day, 1967.
Recommended Operating Procedures for CWC-Related Analysis, Vanninen, P., Ed., Helsinki: The Ministry for Foreign Affairs of Finland, Univ. Helsinki, 2011, p. 67.
Tou, J.T. and Gonzalez, R.C., Pattern Recognition Principles, London: Addison-Wesley, 1974.
ACKNOWLEDGMENTS
The study was supported by the Russian Science Foundation, project no. 15-13-10005, granted to the Kostroma State Technological University.
Author information
Authors and Affiliations
Corresponding author
Additional information
Translated by O. Zhukova
Rights and permissions
About this article
Cite this article
Morozik, Y.I., Dudkin, A.V., Rybal’chenko, I.V. et al. Group Identification of O-Alkyl Alkylphosphonothionofluoridates by Electron Ionization Mass Spectra Using Generalized Spectral Images of Taxonomic Groups. J Anal Chem 73, 1253–1259 (2018). https://doi.org/10.1134/S1061934818130117
Received:
Accepted:
Published:
Issue Date:
DOI: https://doi.org/10.1134/S1061934818130117