Laser desorption ionization Fourier transform ion cyclotron resonance mass spectrometry (LDI-FT-ICR MS) data from soils, soil extracts, and manure samples 0 15520

Project
Department EAC - Working Group BioGeoOmics - Published FT-ICR MS datasets
Description
Processed and quality checked FT-ICR MS data for soil and manure samples (as well as their dried extracts) measured by LDI-FT-ICR MS.

The processed (blank-corrected, base-peak-corrected, normalized) FT-ICR-MS data, including downstream statistical analyses, is provided as a separate table ("ds01.xlsx"). For explanations of variables and abbreviations used in this table, see the overview sheet of the file. Naming convention of mass spectra in other provided datsets (ds02-ds05) and how they relate to data given in ds01 as well as the manuscript/ SI are indicated in Sheet1 of ds01.

Also provided are raw FT-ICR-MS data in four separate datasets (ds02 - ds05, as zipped containers) each containing the complete initial molecular formula assignments ("formulas.csv") and related aggregated values ("eval_summary.csv") as well as a definition file ("repository_file_definition.csv").

Sampling and measurement conditions are described in the respective paper (Simon, C.; Miltner, A.; Mulder, I.; Kaiser, K.; Lorenz, M.; Thiele-Bruhn, S.; Lechtenfeld, O., Long-term effects of manure addition on soil organic matter molecular composition: Carbon transformation as a major driver of energetic potential. Soil Biol. Biochem. 2025, 205. https://doi.org/10.1016/j.soilbio.2025.109755).

More information on the used soil samples and their microbiological and chemical properties can be found here: https://zenodo.org/records/11207502
DOI
https://doi.org/10.48758/ufz.15520
Cite as (APA)
Simon, C., Miltner, A., Mulder, I., Kaiser, K., Lorenz, M., Thiele-Bruhn, S., & Lechtenfeld, O. (2024). Laser desorption ionization Fourier transform ion cyclotron resonance mass spectrometry (LDI-FT-ICR MS) data from soils, soil extracts, and manure samples (Version 1.0) [Data set]. Helmholtz-Zentrum für Umweltforschung. https://doi.org/10.48758/UFZ.15520
Size
287,4 MB
License and Terms of Use
LICENSE and TERMS OF USE
Data quality
quality assured data
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Metadata Catalogues
Dublin Core
URI
https://www.ufz.de/record/dmp/archive/15520
DOI
10.48758/ufz.15520
Subject
FT-ICR-MS
Soil organic matter
Soil fertility
Long-term experiment
Agriculture
Manure
Publication Date
31.05.2024
Coverage
Samples of arable soils were taken at four agricultural long-term experiments. The four sites will be referred to as follows: Dikopshof – DI; Reckenholz – RE; Thyrow – TH; QualiAgro – QA. Soils were sampled with spade after harvest and before next manure application, in 2021 (DH: 08/21, QA/ RE: 09/21, TH: 10/21) and 2022 (DH/TH: 09/22, QA/ RE: 07/22). Soils were dried thereafter. Manure samples were obtained from two sites: Bad Lauchstädt run by UFZ (near Halle/Saale, Germany) in 2007 and Gladbacherhof run by University of Giessen (near Giessen, Germany) in 2023. Manure samples were received in freeze-dried form. More information can be found in the respective paper (see above).
Type of data
dataset (structured data in a defined format)
Data quality
quality assured data
Status of data
processed data
derived data
Data format
csv
xlsx
zip
Creators
Simon, Carsten
Miltner, Anja
Mulder, Ines
Kaiser, Klaus
Lorenz, Marcel
Thiele-Bruhn, Sören
Lechtenfeld, Oliver
Publisher
Helmholtz-Zentrum für Umweltforschung
Rights holders
Helmholtz-Zentrum für Umweltforschung
References to related data
10.1016/j.soilbio.2025.109857
Contact
oliver.lechtenfeld@ufz.de
carsten.simon@ufz.de
Time or Period of creation
01.06.2022 - 31.12.2024
Language of the content
English
Version
1.0
Update policy
stored data will not be extended
Access permissions
free access