Spectrum Details
FooDB ID:FDB005034
Compound name:Heraclenin
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Negative
Splash Key:splash10-000i-0090000000-968438c85a381522a87d
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:C16H14O5
Molecular Weight (Monoisotopic Mass):286.0841 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file275 Bytes
Peak assignments (TSV)Download file947 Bytes
mzML formatted file (MZML)Download file4.33 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 ]