Spectrum Details
MiMe ID:MMDBc0057219
Compound name:Cholyltryptophan
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Negative
Splash Key:splash10-0159-2900740000-d674bfdb63658a01aa34
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:C35H50N2O6
Molecular Weight (Monoisotopic Mass):594.3669 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file957 Bytes
Peak assignments (TSV)Download file4.28 KB
mzML formatted file (MZML)Download file5.28 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 ]