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Journal of Applied Spectroscopy

, Volume 34, Issue 4, pp 445–448 | Cite as

Interpretation of13C NMR signal spectra based on an atlas of known spectra using the method of linear programming

  • L. G. Melkozerova
  • N. E. Gaikov
  • G. P. Gurinovich
Article
  • 11 Downloads

Keywords

Analytical Chemistry Molecular Structure Signal Spectrum 
These keywords were added by machine and not by the authors. This process is experimental and the keywords may be updated as the learning algorithm improves.

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Literature cited

  1. 1.
    D. L. Dalrymple, C. L. Wilkins, G. W. A. Milne, and S. R. Heller, “A Carbon-13 Nuclear Magnetic Resonance Spectral Data Base and Search System,” Org. Magn. Reson.,11, 535–540 (1978).Google Scholar
  2. 2.
    R. Schwarzenbach, I. Meili, H. Konitzer, and I. J. Clerc, “A computer system for structural identification of organic compounds from13C NMR data,” Org. Magn. Reson.,8, 11–16 (1976).Google Scholar
  3. 3.
    R. E. Carhat and C. Djerassi, “Application of artificial intelligence for chemical interference. Part XI. Analysis of carbon-13 nuclear magnetic resonance data for structure elucidation of acyclic amines,” J. Chem. Soc. Perkin Trans. II, 1753–1759 (1973).Google Scholar
  4. 4.
    W. Bremser, M. Klier, and E. Meyer, “Mutual assignment of subspectra and substructures. A way to structure elucidation by13C NMR spectroscopy,” Org. Magn. Reson.,47, 203–206 (1975).Google Scholar
  5. 5.
    B. A. Jerl and D. L. Dalrymple, “Computer program for the retrieval and assignment of chemical environment and shifts to facilitate interpretation of carbon-13 nuclear magnetic resonance spectra,” Anal. Chem.,47, 203–206 (1975).Google Scholar
  6. 6.
    J. M. Mitchel and G. M. Schweuzer, “Application of artificial intelligence for chemical inference. XXV. A computer program for automated empirical13C NMR formation,” Org. Magn. Reson.,11, 378–384 (1978).Google Scholar
  7. 7.
    L. G. Melkozerova, V. P. Suboch, and G. P. Gurinovich, “Identification of microfragments of organic compounds from13C nuclear magnetic resonance spectra,” Zh. Prikl. Spektrosk.,32, 1060 (1980).Google Scholar

Copyright information

© Plenum Publishing Corporation 1981

Authors and Affiliations

  • L. G. Melkozerova
  • N. E. Gaikov
  • G. P. Gurinovich

There are no affiliations available

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