Spectrum Details
T3DB ID:T3D2926
Compound name:Tiagabine
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Negative
Splash Key:splash10-00r2-5294000000-26284b1d5f7adf9241ff
Notes:This is a predicted spectrum and it should only be used as a guide, further evidence is required to confirm identification.
Spectrum View
Experimental Conditions
Ionization Mode:Negative
Collision Energy:40 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C20H25NO2S2
Molecular Weight (Monoisotopic Mass):375.1327 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file993 Bytes
Peak assignments (TSV)Download file2.78 KB
mzML formatted file (MZML)Download file5.33 KB
References
  1. Wang F, Liigand J, Tian S, Arndt D, Greiner R, and Wishart D. CFM-ID 4.0: More Accurate ESI MS/MS Spectral Prediction and Compound Identification. Analytical Chemistry202193 (34), 11692-11700 DOI: 10.1021/acs.analchem.1c01465 [PubMed: 34403256 ]