Combining Techniques to Deduce Structures
No single technique proves a structure. In exam questions you combine evidence from several:
• Elemental analysis (percentage composition) gives the empirical formula.
• Mass spectrometry: the molecular ion peak, M+, gives the relative molecular mass, and so the molecular formula. Fragment peaks show parts of the molecule.
• Infrared spectroscopy identifies functional groups: C=O 1630-1820 cm-1, broad O-H of a carboxylic acid 2500-3300 cm-1, O-H of an alcohol 3200-3600 cm-1.
• 13C NMR gives the number of different carbon environments and their types.
• 1H NMR gives the number of proton environments, their types (δ), the ratio of protons (peak areas) and the neighbouring protons (splitting).
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Key terms in this lesson
- empirical formula
- A formula that shows the simplest whole-number ratio of atoms of each element in a compound.
- molecular formula
- A formula that shows the actual number of atoms of each element in a molecule.
More in NMR Spectroscopy
- Deuterated Solvents
- 13C NMR Spectroscopy
- Interpreting 13C NMR Spectra
- 1H NMR Spectroscopy
- Relative Peak Areas
- Spin-Spin Splitting
- The n+1 Rule
- Identifying O-H and N-H Protons with D2O
All 12 lessons in NMR Spectroscopy · All OCR A-level Organic Chemistry topics