Spectrum Details
FooDB ID:FDB030089
Compound name:(1R,6R)-6-hydroxy-2-succinylcyclohexa-2,4-diene-1-carboxylate
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Positive
Splash Key:splash10-0ukj-9700000000-4e419d6f1a3b4d06cde0
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:Positive
Collision Energy:40 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C11H12O6
Molecular Weight (Monoisotopic Mass):240.0634 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file978 Bytes
Peak assignments (TSV)Download file2.16 KB
mzML formatted file (MZML)Download file5.32 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 ]