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Jak vypočítat Mass Spec

Co je Mass Spec?

Mass spectrometry measures mass-to-charge ratios (m/z) of ions; determines molecular weight and fragment composition.

Průvodce krok za krokem

  1. 1Input mass spectrum peaks and intensities
  2. 2Identify molecular ion, fragments, and base peak
  3. 3Determine molecular structure

Worked Examples

Vstup
Molecular ion m/z = 88, base peak m/z = 73 (M-15, loss of CH₃)
Výsledek
Suggests methyl group loss

Common Mistakes to Avoid

  • Misidentifying molecular ion (not always M⁺)
  • Not accounting for isotope patterns

Frequently Asked Questions

What's base peak?

Most intense peak; usually stable fragment ion; useful for structure determination.

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