Molecular Weight Formula:
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Molecular weight is the sum of the atomic masses of all atoms in a molecule. It is expressed in atomic mass units (u) and is crucial for identifying compounds in mass spectrometry.
The calculator uses the formula:
Where:
Explanation: The calculator sums the product of each element's atomic mass and its count in the molecule.
Details: Accurate molecular weight calculation is essential for interpreting mass spectra, identifying unknown compounds, and confirming molecular structures.
Tips: Enter elements and their counts in the format "Element:Count" separated by commas (e.g., "C:6,H:12,O:6"). Use standard element symbols.
Q1: What atomic mass values are used?
A: The calculator uses standard atomic weights based on IUPAC recommendations.
Q2: How accurate is this calculation?
A: The calculation provides theoretical molecular weight. Actual measurements may vary slightly due to isotopic distributions.
Q3: Can I calculate molecular weight for ions?
A: For ions, adjust the calculation by adding/subtracting the mass of electrons gained/lost.
Q4: What about isotopic variants?
A: This calculator uses average atomic masses. For exact isotopic calculations, specialized software is needed.
Q5: How does this help in mass spec analysis?
A: Comparing calculated molecular weights with measured m/z values helps identify molecular ions and fragment ions.