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


Analytical Chemistry Molecular Structure Signal Spectrum 
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Literature cited

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    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
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    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
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    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
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    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
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    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
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    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
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    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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