Spectrum Details
FooDB ID:FDB029656
Compound name:(E,E)-2,4-heptadienal
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Negative
Splash Key:splash10-0a4i-4900000000-aff98f20a766bae26fb8
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:C7H10O
Molecular Weight (Monoisotopic Mass):110.0732 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file69 Bytes
Peak assignments (TSV)Download file118 Bytes
mzML formatted file (MZML)Download file4.08 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 ]