MetaSci Tandem Mass Spectrometry Library

Kurfman, Emily A.; Kertesz, Vilmos; Cahill, John F

doi:10.25983/3011933

Title: MetaSci Tandem Mass Spectrometry Library

Dataset
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Abstract

These data are pure standard mass spectral libraries were collected on Orbitrap (Thermo QE-HF) and Q-TOF (SCIEX 5600) mass spectrometers for 192 compounds using 6 different collision energies, respectively. Libraries were acquired while using different solvent additives, precursor adducts, and ion polarities.

Authors:

Kurfman, Emily A.; Kertesz, Vilmos; Cahill, John F

Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)

Publication Date:: Tue Jan 06 00:00:00 UTC 2026

DOE Contract Number:: AC05-00OR22725

Research Org.:: ORNL BioSciences Division (ORNL-BSD)

Sponsoring Org.:: US DOE Office of Science

Subject:: 47 OTHER INSTRUMENTATION; Tandem Mass Spectrometry Library MetaSci

OSTI Identifier:: 3011933

DOI:: https://doi.org/10.25983/3011933

Citation Formats


                    Kurfman, Emily A., Kertesz, Vilmos, and Cahill, John F. MetaSci Tandem Mass Spectrometry Library.  United States: N. p., 2026. 
        Web.  doi:10.25983/3011933.

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                    Kurfman, Emily A., Kertesz, Vilmos, & Cahill, John F. MetaSci Tandem Mass Spectrometry Library.  United States.  doi:https://doi.org/10.25983/3011933

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                    Kurfman, Emily A., Kertesz, Vilmos, and Cahill, John F. 2026.  
"MetaSci Tandem Mass Spectrometry Library".  United States.  doi:https://doi.org/10.25983/3011933.  https://www.osti.gov/servlets/purl/3011933. Pub date:Tue Jan 06 00:00:00 UTC 2026

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@article{osti_3011933,

  title        = {MetaSci Tandem Mass Spectrometry Library},

  author       = {Kurfman, Emily A. and Kertesz, Vilmos and Cahill, John F},

  abstractNote = {These data are pure standard mass spectral libraries were collected on Orbitrap (Thermo QE-HF) and Q-TOF (SCIEX 5600) mass spectrometers for 192 compounds using 6 different collision energies, respectively. Libraries were acquired while using different solvent additives, precursor adducts, and ion polarities.},

  doi          = {10.25983/3011933},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Tue Jan 06 00:00:00 UTC 2026},

  month        = {Tue Jan 06 00:00:00 UTC 2026}

}

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DOI: https://doi.org/10.25983/3011933

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