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m/z by charge
| Charge (z) | Adduct | m/z |
|---|
Amino acid composition
Example data
These examples auto-calculate using current settings. Click a row to load the sequence.
| Sequence | Length | Neutral mass (Da) | z=2 m/z (adduct) |
|---|---|---|---|
ACDE |
– | – | – |
PEPTIDE |
– | – | – |
MKWVTFISLLFLFSSAYSR |
– | – | – |
What is the molecular weight of a peptide with the sequence ala-ala-arg-asn?
Lowercase names map to one-letter codes: ALA–ALA–ARG–ASN → AARN.
- Monoisotopic neutral mass: 430.228831 Da
- Average neutral mass: 430.464180 Da
Assumes free termini and no modifications; mass equals Σ residues + H2O.
Amino acid residue masses reference
Residue masses exclude water; one H2O is added for free termini.
| Residue | Monoisotopic (Da) | Average (Da) |
|---|
Supported modifications and delta masses
| Modification | Target | Δ mass (Da) | Applied as |
|---|
Phosphorylation adds 79.966331 per modified S, T, or Y residue.
Formula used
Two equivalent approaches exist. We use residue masses and add water:
Neutral mass = Σ(residue masses) + mass(H2O) + Σ(fixed mods) + custom delta.
Residue masses already exclude water; adding one H2O restores free termini.
- mass(H2O): 18.010565 (monoisotopic) or 18.01528 (average)
- N-term acetylation: +42.010565; C-term amidation: −0.984016
- Carbamidomethyl on C: +57.021464 each C
- Oxidation on M: +15.994915 each M
- Phosphorylation on S/T/Y: +79.966331 each modified residue
m/z for charge z with adduct mass A is: m/z = (Neutral mass + z·A) / z.
Adduct masses used: H+ 1.007276466, Na+ 22.989218, K+ 38.963158.
how to calculate molecular weight of peptide?
- Select a mass model: Monoisotopic or Average.
- Convert names to one‑letter codes and clean the sequence.
- Sum residue masses from a residue mass table.
- Add one H2O to restore free termini.
- Add fixed/variable modifications and any custom delta mass.
- For m/z, add z adduct masses and divide by z.
Worked example (monoisotopic): ACDE
| Residue | Mass (Da) |
|---|---|
| A | 71.037114 |
| C | 103.009185 |
| D | 115.026943 |
| E | 129.042593 |
| Σ residues | 418.115835 |
| + H2O | 18.010565 |
| Neutral mass | 436.126400 |
Assumes free termini and no modifications. Use the checkboxes to add PTMs.
Key constants
- H2O (mono): 18.010565
- H2O (avg): 18.01528
- H+: 1.007276466
- Na+: 22.989218
- K+: 38.963158
Common PTMs: CAM on C +57.021464, Oxidation on M +15.994915, Phospho on S/T/Y +79.966331.
How to use this calculator
- Paste a peptide sequence using one-letter amino acid codes.
- Select the mass model and choose termini options if needed.
- Tick common modifications to apply across matching residues.
- Add any custom delta mass and its count if applicable.
- Enter charge states to compute m/z values for the chosen adduct.
- Click Calculate to see mass, composition, and m/z table.
- Use Download CSV or Download PDF to save results.
- Click Shareable URL to encode current inputs in the address bar.
Tip: Click any example row to load that sequence into the form.