Spectrum Details
MiMe ID:MMDBc0057254
Compound name:Chenodeoxycholylserine
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Negative
Splash Key:splash10-004i-0000900000-f77589a34e97b3bf3fb4
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:10 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C27H45NO6
Molecular Weight (Monoisotopic Mass):479.3247 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file500 Bytes
Peak assignments (TSV)Download file2.2 KB
mzML formatted file (MZML)Download file4.64 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 ]