compute molecular mass from chemical formula
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wewolski ▴ 10
@wewolski-8499
Last seen 3 days ago
Zurich

Looking for a function that returns the exactmass (monoisotopic mass) given a chemical formula in the following format:

c("C25H40N7O19P3S", "C25H40N7O19P3S", "C25H40N7O19P3S", "C25H40N7O19P3S" ,
"C9H12O4" ,       "C9H12O4",        "C9H12O4",        "C11H10N2O2",     "C8H16NO9P"   ,   "C8H16NO9P"    ,  "C8H16NO9P"  ,    "C8H16NO9P")

Metabolomics • 51 views
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@a7cd8c24
Last seen 10 days ago
Pakistan
1. The mole allows scientists to calculate the number of elementary entities (usually atoms or molecules ) in a certain mass of a given substance. 2.Avogadro’s number is an absolute number: there are 6.022×1023 elementary entities in 1 mole. This can also be written as 6.022×1023 mol-1.
1. The mass of one mole of a substance is equal to that substance’s molecular weight. For example, the mean molecular weight of water is 18.015 atomic mass units (amu), so one mole of water weight 18.015 grams.
2. Key Terms mole: The amount of substance of a system that contains as many elementary entities as there are atoms in 12 g of carbon-12.

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