Windowing combined with ion-ion reactions for chemical noise elimination
In a first location of a mass spectrometer, a plurality of ionized molecules of an ion source are selected that have mass-to-charge ratios within a mass-to-charge ratio window width. The plurality of selected ionized molecules are transmitted from a first to a second location. Reagent ions are transmitted to the second location to reduce a charge state of one or more of the plurality of selected ionized molecules. A mass analyzer is used to analyze the plurality of reduced ionized molecules and produce a mass spectrum. A compound is identified from a peak of the spectrum that has a mass-to-charge ratio less than or equal to the highest mass-to-charge ratio in the window width if the noise is multiply charged and greater than the highest mass-to-charge ratio in the window width if the noise is singly charged.
1. A system for identifying a multiply charged ion of a compound from singly charged chemical noise ions in mass spectrometry, comprising:
a mass spectrometer that
selects a plurality of ionized molecules of an ion source that have mass-to-charge ratios within a mass-to-charge ratio window width in a first location,
transmits the plurality of selected ionized molecules from the first location to a second location,
transmits a plurality of reagent ions to the second location to reduce a charge state of one or more of the plurality of selected ionized molecules,
analyzes the plurality of reduced ionized molecules, and
produces a mass spectrum using a mass analyzer; and
a processor that identifies a compound from a mass peak of the mass spectrum that has a mass-to-charge ratio greater than the highest mass-to-charge ratio in the mass-to-charge ratio window width by
locating a second mass peak of the spectrum that has a second peak mass-to-charge ratio within the mass-to-charge ratio window width, and
identifying the compound from the mass peak and the second mass peak if a difference between the peak mass-to-charge ratio and the second peak mass-to-charge ratio is explained by a reduction in charge state of a mass.
2. The system of claim 1 , wherein the processor identifies a compound from a mass peak of the mass spectrum that has a peak mass-to-charge ratio greater than the highest mass-to-charge ratio in the mass-to-charge ratio window width by searching a database of known compounds for a compound with the peak mass-to-charge ratio.
3. The system of claim 1 , wherein the processor further searches a database of known compounds for the mass.
4. The system of claim 1 , wherein the processor identifies a compound from a mass peak of the mass spectrum that has a peak mass-to-charge ratio greater than the highest mass-to-charge ratio in the mass-to-charge ratio window width by
identifying one or more isotopic mass peaks of the mass spectrum near the mass peak and determining a mass of the compound from the mass peak and the one or more isotopic mass peaks.
5. A method for identifying a multiply charged ion of a compound from singly charged chemical noise ions in mass spectrometry, comprising:
selecting a plurality of ionized molecules of an ion source that have mass-to-charge ratios within a mass-to-charge ratio window width in a first location of a mass spectrometer;
transmitting the plurality of selected ionized molecules from the first location to a second location of the mass spectrometer;
transmitting a plurality of reagent ions to the second location to reduce a charge state of one or more of the plurality of selected ionized molecules;
analyzing the plurality of reduced ionized molecules and producing a mass spectrum using a mass analyzer of the mass spectrometer; and
identifying a compound from a mass peak of the mass spectrum that has a mass-to-charge ratio greater than the highest mass-to-charge ratio in the mass-to-charge ratio window width, comprising
locating a second mass peak of the spectrum that has a second peak mass-to-charge ratio within the mass-to-charge ratio window width, and
identifying the compound from the mass peak and the second mass peak if a difference between the peak mass-to-charge ratio and the second peak mass-to-charge ratio is explained by a reduction in charge state of a mass.
6. The method of claim 5 , wherein identifying a compound from a mass peak of the mass spectrum that has a peak mass-to-charge ratio greater than the highest mass-to-charge ratio in the mass-to-charge ratio window width further comprises searching a database of known compounds for a compound with the peak mass-to-charge ratio.
7. The method of claim 5 , further comprising searching a database of known compounds for the mass.
8. The method of claim 5 , wherein identifying a compound from a mass peak of the mass spectrum that has a peak mass-to-charge ratio greater than the highest mass-to-charge ratio in the mass-to-charge ratio window width further comprises identifying one or more isotopic mass peaks of the mass spectrum near the mass peak and determining a mass of the compound from the mass peak and the one or more isotopic mass peaks.