Spectrum Details
FooDB ID:FDB112398
Compound name:3-Oxodocosanoyl-CoA
Spectrum type:Predicted LC-MS/MS Spectrum - 20V, Positive
Splash Key:splash10-000i-9711100133-d8aa47d5a7471640eaa1
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:Positive
Collision Energy:20 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C43H76N7O18P3S
Molecular Weight (Monoisotopic Mass):1103.418 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file987 Bytes
Peak assignments (TSV)Download file6.8 KB
mzML formatted file (MZML)Download file5.3 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 ]