Hmdb loader
Spectrum Details
HMDB ID:HMDB0268440
Compound name:PA(i-22:0/18:3(9,11,15)-OH(13))
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Negative
Splash Key:splash10-002u-1169600100-f4ed8065e4fcde8f1d0d
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:C43H79O9P
Molecular Weight (Monoisotopic Mass):770.5462 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file157 Bytes
Peak assignments (TSV)Download file533 Bytes
mzML formatted file (MZML)Download file4.21 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 ]