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Spectrum Details
HMDB ID:HMDB0274013
Compound name:PGP(18:1(9Z)-O(12,13)/22:5(4Z,7Z,10Z,13Z,16Z))
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Negative
Splash Key:splash10-014i-0020000009-aa2fe212205c967d3bc1
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:C46H78O14P2
Molecular Weight (Monoisotopic Mass):916.4867 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file323 Bytes
Peak assignments (TSV)Download file1.62 KB
mzML formatted file (MZML)Download file4.42 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 ]