Spectrum Details
T3DB ID:T3D2836
Compound name:Cisapride
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Negative
Splash Key:splash10-0il0-9411000000-a20e7213ffcaf2d0f91f
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:C23H29ClFN3O4
Molecular Weight (Monoisotopic Mass):465.1831 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file489 Bytes
Peak assignments (TSV)Download file1.52 KB
mzML formatted file (MZML)Download file4.69 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 ]