Organic Chemistry Structure Determination

Uses of 1H NMR Spectra and 13C NMR Spectroscopy

Topic overview

Start with the big picture

In ¹H NMR, the number of signals reflects distinct proton environments, chemical shifts indicate their electronic surroundings, and integration provides relative proton counts. Multiplet patterns and coupling constants help identify neighboring protons and can support stereochemical assignments; exchangeable protons may be checked with a D₂O shake. ¹³C NMR distinguishes unique carbon environments, while chemical shifts help classify broad carbon types. DEPT experiments indicate whether carbons bear hydrogen, and HSQC or HMQC links protons to directly attached carbons. HMBC provides longer-range connectivity, helping join structural fragments. Together, these methods offer complementary evidence for interpreting molecular structure.

Learning objectives

What you'll learn

  • Interpret ¹H NMR signal count, chemical shift, integration, and splitting.
  • Use coupling patterns and constants to assess neighboring protons and stereochemical relationships.
  • Recognize carbon environments using ¹³C chemical shifts and DEPT results.
  • Explain how HSQC, HMQC, and HMBC contribute to connectivity assignments.
  • Combine ¹H and ¹³C NMR observations to support structural interpretation.
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