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Analytical Chemistry & Spectroscopy

Fragmentation Pattern

The characteristic set of smaller ions produced when a molecular ion breaks apart in a mass spectrometer.

Unit Da

In depth

Bonds break preferentially where the resulting cation is most stable, so the pattern is reproducible and diagnostic. Characteristic mass losses — 15 for a methyl group, 18 for water, 29 for an ethyl or formyl group — identify structural features directly.

Examples in the real world

A McLafferty rearrangement in ketones giving a distinctive even-mass fragment.