Chlorine-35 2026-11-05
Chlorine-35 is a stable isotope of chlorine, with 17 protons and 18 neutrons in its atomic nucleus. Its mass number is , while its measured relative atomic mass is approximately . NIST lists representative natural fractions for chlorine-35 and for chlorine-37.[ref]
Atomic Weights and Isotopic Compositions for All Elements by National Institute of Standards and Technology. Chlorine rows 35 and 37, masses and compositions
Those fractions explain a characteristic mass spectrometry pattern. In an idealized sample of with independently paired isotope identities, the three molecular combinations have probabilitiesThe middle term has a factor of two because either atom can be the heavier isotope. For singly charged molecular ions, the combinations give nominal mass peaks at 70, 72 and 74. A mass spectrometer separates ions by mass-to-charge ratio, so the two-unit spacing encodes isotope composition rather than three different chemical elements. These are ideal abundance predictions; actual peak intensities also depend on fragmentation and instrumental response.
Chlorine-35 is the stable daughter in sulfur-35 beta-minus decay: increases from 16 to 17 while the mass number remains 35.[ref] Neither that origin nor the presence of chlorine-35 makes an ordinary chlorine-containing compound radioactive.
Daryl Wilding-McBride 2026-11-05
Daryl Wilding-McBride is an author of research on computational analysis of mass spectrometry data. A 2022 paper with collaborators developed processing methods for precursor and fragment spectra acquired on a timsTOF instrument, with the aim of improving peptide feature characterization and identification.[ref]
One useful contribution concerns detector saturation. Strong isotopic peaks can cease to represent their true relative intensities. The paper uses a theoretical model of tryptic-peptide peak-height ratios and an unsaturated later isotope to infer earlier peak intensities, including the monoisotopic peak. This is model-based reconstruction, not a second direct measurement of a saturated signal.[ref]
Simplifying MS1 and MS2 spectra to achieve lower mass error, more dynamic range, and higher peptide identification confidence on the Bruker timsTOF Pro by Daryl Wilding-McBride and others. §3.3, Correcting intensity readings in saturation; Figures7–10
For an original calculation illustrating the inference, suppose a declared model predicts and an unsaturated later peak has intensity arbitrary units. The inferred earlier intensity is units. The arithmetic is straightforward; whether it is informative depends on the appropriateness of the isotope-ratio model and the reliability of the unsaturated measurement.
The paper evaluates such processing in defined proteomic mixtures. Its detector threshold and applicable isotope/mass ranges belong to that data-processing setup, rather than constituting universal limits for every mass spectrometer. The example illustrates how a software correction can recover a useful estimate while retaining dependence on its physical and statistical assumptions.[ref]
Extracted ion chromatogram 2026-11-05
An extracted ion chromatogram is an extracted ion profile whose time axis follows a chromatographic separation. A mass spectrometer records successive mass spectra as separated material reaches the ion source; software follows a chosen mass-to-charge ratio interval through those spectra. It is a selected view of the recorded data rather than a direct picture of a single chemical species.[ref]
Extracted ion profile in IUPAC Gold Book. Entry12410, selected mass/time profile and chromatographic example.
The apparatus supplies two kinds of discrimination: chromatography changes when material reaches the detector, while mass analysis distinguishes ion coordinates at each time. An extracted ion mass window specifies which recorded coordinates contribute. A narrow window cannot separate two coeluting species whose relevant ions occupy the same mass coordinate.
An extracted-ion chromatogram peak area integrates selected signal over an explicitly chosen time range. For original sample points , in minutes and arbitrary signal units, straight-line interpolation givesThe unweighted sum of ordinates is4, which ignores the unequal time intervals. These stipulated data illustrate numerical integration, not an experimental chromatogram.
Peak height and area also answer different questions. Triangular model peaks with height5 and full base widths2 and4 minutes have areas5 and10 signal-unit minutes. The same peak height does not imply the same integrated response. Converting area to amount requires an appropriate calibration and response model.
State the mass window, acquisition time spacing, baseline and time boundaries. Changes in baseline or overlap can change assigned area without changing analyte amount. Comparing retention behavior and other chemical evidence helps interpret a selected trace; its apparent isolation alone does not establish identity or freedom from analytical matrix effects.
Mass analyzer 2026-11-05
A mass analyzer is the part of a mass spectrometer that makes ions distinguishable or selectively transmits them according to mass-to-charge ratio. The measured coordinate can be position, arrival time or transmission under a specified field setting. A separate mass spectrometer detector records the resulting signal.
A quadrupole mass analyzer selects trajectories using combined static and time-varying electric fields: chosen mass-to-charge values remain on stable paths while others are lost from the transmitted beam.[ref] A time-of-flight mass spectrometer instead encodes the ratio in arrival time after acceleration. Different physical designs can therefore provide the same kind of ionic-mass information through different observables.
An original magnetic example exposes an important assumption. For speed perpendicular to a uniform magnetic field , balancing the Lorentz force and circular acceleration givesIf the incoming ions have the same selected speed and charge, mass values in the ratio give bending radii in that ratio, about . But if ions instead start negligibly slowly and gain energy from the same electric potential difference , substituting gives . Their radius ratio is then . The initial-condition choice changes the mapping.
Analysis requires this mapping and its assumptions, not just separated peaks. Mass resolving power describes the ability to distinguish nearby peak coordinates under a stated width criterion; accurate assignment of those coordinates additionally needs instrument calibration and the correct charge-state interpretation.
Mass spectrometer 2026-11-05
A mass spectrometer is an instrument that produces or receives ions, separates them according to mass-to-charge ratio, and records their signals. Its major functions are supplied by an ion source, a mass analyzer and a mass spectrometer detector. The result is a mass spectrum; interpreting a peak also requires knowing which ionic chemical species produced it.
The 1955 instrument described by W. C. Wiley and I. H. McLaren provides a concrete apparatus example. An ion source and accelerating fields launch ions into an evacuated drift region toward a collector. Arrival times separate mass-to-charge ratios; the paper analyses how initial positions and velocities broaden the recorded peaks, and uses a two-field ion-gun geometry to improve focusing.[ref]
Time-of-Flight Mass Spectrometer with Improved Resolution by W. C. Wiley and I. H. McLaren. Page 1150, general description; subsequent resolution analysis and two-field ion gun
This is one analyzer design, not a definition requiring every mass spectrometer to measure flight time.For an ideal time-of-flight mass spectrometer, neglect initial speed and acceleration duration. Across an electric potential difference , an ion of positive electric charge gains . A field-free drift of length then givesIf one peak arrives at and another at , identical acceleration and drift conditions imply a mass-to-charge ratio ratio . It is a mass ratio only if the charge states are also equal. Peak position, width and intensity answer different questions: ionic identity, resolving ability and response-weighted abundance.
Mass spectrometry imaging 2026-11-05
Mass spectrometry imaging associates mass spectra with positions in a specimen, allowing an image to be formed for a chosen mass-to-charge ratio or spectral feature. Instead of reducing the whole specimen to one spectrum, it retains a link between molecular signal and location.
A 1997 experiment used matrix-assisted laser desorption/ionization, MALDI, to collect an ordered array of spectra from coated tissue sections or tissue imprints. Selected-ion images mapped peptides and proteins; one demonstration localized insulin in rat pancreatic tissue.[ref]
Molecular imaging of biological samples: localization of peptides and proteins using MALDI-TOF MS by R. M. Caprioli and others. Abstract, sample coating, ordered spectra and tissue demonstrations
The apparatus couples controlled sampling positions with a mass spectrometer; an image pixel records a spectral measurement, not a conventional colour photograph.An original two-position example shows why interpretation depends on scaling. A selected feature gives raw signals 10 and 20, while the respective summed spectral signals are 100 and 400. The second position is twice as bright in the raw feature image. Dividing each feature by its local total gives and , reversing which position has the larger fraction. Mass spectrometry image normalization changes the question being displayed; neither version alone is a universal concentration map.
Spatial sampling, material redistribution during preparation, ion production and detector response can all affect the result. A common peak coordinate does not by itself resolve every molecule with the same nominal mass or establish biological function. Retaining spectra, coordinates and processing choices makes the image scientifically interpretable.
Sulfur-34 2026-11-05
Sulfur-34 is a stable isotope of sulfur with 16 protons and 18 neutrons in its atomic nucleus. Its mass number is , while its relative atomic mass is approximately . NIST lists a representative isotopic abundance of , or , alongside for sulfur-32.[ref]
Atomic Weights and Isotopic Compositions for All Elements by National Institute of Standards and Technology. Sulfur rows 32 and 34, isotope masses and compositions
The representative composition does not require every natural sample to have exactly those fractions.Comparing sulfur-34 with sulfur-32 illustrates how an isotope ratio differs from a fraction of all sulfur. The representative ratio isIn an idealized measurement that has already corrected differences in response and interferences, suppose the inferred atom counts are and . Their ratio is , about higher than that representative ratio. This compares two isotopes; calculating the sulfur-34 fraction of all sulfur additionally needs the other isotopes in the denominator. Raw mass spectrometer signals are not automatically corrected atom counts.
Sulfur-34 and sulfur-32 have the same atomic number, so replacing one with the other preserves the element while changing nuclear mass. This makes isotope composition an additional descriptor of a sulfur-containing sample, distinct from its chemical formula. A stable isotope also provides a different kind of label from radioactive sulfur-35: its usefulness does not depend on detecting radioactive decay.
Time-of-flight mass spectrometer 2026-11-05
A time-of-flight mass spectrometer is a mass spectrometer whose analyzer infers mass-to-charge ratio from ion arrival times. A simple arrangement uses an ion source, pulsed acceleration, a drift region under vacuum and a mass spectrometer detector. The 1955 Wiley–McLaren instrument connected such an apparatus to calculations of how initial position and velocity spread affect resolution.[ref]
Time-of-Flight Mass Spectrometer with Improved Resolution by W. C. Wiley and I. H. McLaren. Page 1150, general description; two-field focusing and resolution analysis
In an ideal drift, for flight length , positive charge and accelerating electric potential difference . Recorded arrival time can also include a time-of-flight timing offset . A useful ideal instrument calibration model iswhere is the numerical mass-to-charge coordinate in a declared unit and absorbs the instrument geometry and unit conversion.
For original invented standards, let arrive at and at . Since the square roots are 5 and 10, and . An unknown arriving at then has . Ignoring the offset and scaling from the first standard alone would instead give . A timing offset becomes a mass-assignment error when omitted from the model.
Real peaks have finite widths. Space focusing and time-lag focusing address specified sources of that spread; neither is simply a longer wait before detection. Calibration standards, acquisition timing and focusing conditions therefore belong in the interpretation of a measured spectrum.