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Spectroscopy and Chromatography

Fragmentation and the formulae of fragment ions

  • 3 things to know
  • Unit A2 2

Overview

Recall questions on what fragmentation is and why only the charged piece is detected, suggesting formulae for the peaks at m/z 15, 29 and 43, finding the neutral fragment lost by subtraction, why propanone gives a strong peak at 43, distinguishing propanal from propanone and butane from methylpropane, and the pattern as a fingerprint.

What you need to know

Answer each one before you reveal it.

Your recallNot started
Key term

What is fragmentation?

Key term

When a molecular ion breaks into two pieces, why does only one of them appear in the mass spectrum?

Key term

What fragment gives a peak at m/z 15?

Questions from this subtopic

Each one with the model answer underneath.

  1. 1

    What is fragmentation?

    Model answer

    The breaking apart of the molecular ion into smaller pieces, one of which keeps the positive charge and is detected.

  2. 2

    Why does only one fragment appear in the spectrum?

    Model answer

    The molecular ion carries a single positive charge, so when it breaks only one of the two pieces is charged and the neutral piece is not detected.

  3. 3

    How is the formula of a fragment ion suggested?

    Model answer

    Its mass to charge ratio is matched to a combination of atoms consistent with the molecular formula of the compound.

  4. 4

    What fragment gives a peak at m/z 15?

    Model answer

    The methyl cation, CH₃⁺.

  5. 5

    What fragment gives a peak at m/z 29?

    Model answer

    Either the ethyl cation C₂H₅⁺ or the acylium fragment CHO⁺, since both have that mass.

  6. 6

    What fragment gives a peak at m/z 43?

    Model answer

    The propyl cation C₃H₇⁺ or the ethanoyl cation CH₃CO⁺.

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