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Spectrum Details
HMDB ID:HMDB0297964
Compound name:DG(a-21:0/0:0/LTE4)
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Negative
Splash Key:splash10-00di-0005110090-89657a5a8a86f0bfed7f
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:C47H83NO8S
Molecular Weight (Monoisotopic Mass):821.5839 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file377 Bytes
Peak assignments (TSV)Download file1.47 KB
mzML formatted file (MZML)Download file4.51 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 ]