Spectrum Details
FooDB ID:FDB020226
Compound name:Isothymonin
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Negative
Splash Key:splash10-0a4i-0009000000-1b2458f70b43c2827ff8
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:C18H16O8
Molecular Weight (Monoisotopic Mass):360.0845 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file52 Bytes
Peak assignments (TSV)Download file170 Bytes
mzML formatted file (MZML)Download file4.07 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 ]