Dimercaprol Fragment Masses from GC/MS-QTOF with Electron Ionization

High-resolution experimental peaks and exact masses calculated for dimercaprol-derived fragments (BAL) in GC/MS-QTOF with electron ionization (EI). The dataset was authored by Miguel Fernando Molano and is available as a 5.5 KB XLS file. It was last updated on June 1, 2026.

Use Cases

• Calibrating mass spectrometers based on high-resolution experimental peak data.
• Identifying dimercaprol-derived fragments in complex samples based on exact masses.
• Developing reference libraries for GC/MS-QTOF analysis of chemical compounds.
• Validating theoretical mass calculations against experimental data for electron ionization fragments.

Strengths

• Data includes high-resolution experimental peaks, which are precise for identification.
• Exact masses are calculated, providing a reference for theoretical comparisons.
• The dataset is small (5.5 KB), making it quick to download and inspect.

Limitations

• Row count is unknown, which may limit suitability assessment.
• Column-level documentation is absent; field semantics must be inferred after download.
• Description metadata is limited; actual data quality requires manual inspection after download.

Provenance

Source

Miguel Fernando Molano via figshare

Collection Method

Likely contains experimental data from GC/MS-QTOF analysis with electron ionization.

Freshness

Last updated 2026-06-01 17:59:09; freshness should be verified.