Literature DB >> 31062289

Elemental Composition Determinations Using the Abundant Isotope.

Robert B Cody1, Thierry Fouquet2.   

Abstract

Elemental compositions are commonly determined from the exact m/z of the monoisotopic peak, which is often the lightest isotope. However, the lightest isotope peak is often weak or absent and the monoisotopic peak can be difficult to identify for organometallics, polyhalogenated compounds, or large molecules. An alternative approach using the abundant isotope for elemental composition determinations is presented here.

Keywords:  Elemental compositions; Halogenated; Isotope; Organometallic; Software

Year:  2019        PMID： 31062289     DOI： 10.1007/s13361-019-02203-9

Source DB:  PubMed          Journal:  J Am Soc Mass Spectrom        ISSN： 1044-0305            Impact factor:   3.109


  9 in total

1.  Highly accurate chemical formula prediction tool utilizing high-resolution mass spectra, MS/MS fragmentation, heuristic rules, and isotope pattern matching.

Authors:  Tomáš Pluskal; Taisuke Uehara; Mitsuhiro Yanagida
Journal:  Anal Chem       Date:  2012-04-26       Impact factor: 6.986

2.  Versatile new ion source for the analysis of materials in open air under ambient conditions.

Authors:  Robert B Cody; James A Laramée; H Dupont Durst
Journal:  Anal Chem       Date:  2005-04-15       Impact factor: 6.986

3.  Determination of ion and neutral loss compositions and deconvolution of product ion mass spectra using an orthogonal acceleration time-of-flight mass spectrometer and an ion correlation program.

Authors:  Andrew H Grange; Michael C Zumwalt; G Wayne Sovocool
Journal:  Rapid Commun Mass Spectrom       Date:  2006       Impact factor: 2.419

Review 4.  Accurate mass measurement for the determination of elemental formula--a tutorial.

Authors:  Anthony W T Bristow
Journal:  Mass Spectrom Rev       Date:  2006 Jan-Feb       Impact factor: 10.946

5.  Isotope pattern evaluation for the reduction of elemental compositions assigned to high-resolution mass spectral data from electrospray ionization Fourier transform ion cyclotron resonance mass spectrometry.

Authors:  Norbert Stoll; Enrico Schmidt; Kerstin Thurow
Journal:  J Am Soc Mass Spectrom       Date:  2006-08-22       Impact factor: 3.109

6.  Determination of elemental compositions from mass peak profiles of the molecular ion (m) and the m + 1 and m + 2 ions.

Authors:  A H Grange; J R Donnelly; G W Sovocool; W C Brumley
Journal:  Anal Chem       Date:  1996-02-01       Impact factor: 6.986

7.  Follow-up comment on the use of alternative mass reference standards for Direct Analysis in Real Time mass spectrometry.

Authors:  Robert B Cody
Journal:  Rapid Commun Mass Spectrom       Date:  2016-10-15       Impact factor: 2.419

8.  Alternative mass reference standards for direct analysis in real time mass spectrometry.

Authors:  Robert B Cody; A John Dane
Journal:  Rapid Commun Mass Spectrom       Date:  2016-05-30       Impact factor: 2.419

9.  SIRIUS: decomposing isotope patterns for metabolite identification.

Authors:  Sebastian Böcker; Matthias C Letzel; Zsuzsanna Lipták; Anton Pervukhin
Journal:  Bioinformatics       Date:  2008-11-17       Impact factor: 6.937
  9 in total
  1 in total

1.  Kendrick Analysis and Complex Isotopic Patterns: A Case Study of the Compositional Analysis of Pristine and Heated Polybrominated Flame Retardants by High-Resolution MALDI Mass Spectrometry.

Authors:  Sayaka Nakamura; Hiroaki Sato; Thierry N J Fouquet
Journal:  Mass Spectrom (Tokyo)       Date:  2020-02-06
  1 in total

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