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Kaip apskaičiuoti Mass Spec

Kas yra Mass Spec?

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

Žingsnis po žingsnio vadovas

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

Worked Examples

Įvestis
Molecular ion m/z = 88, base peak m/z = 73 (M-15, loss of CH₃)
Rezultatas
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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