Spectrum Details
FooDB ID:FDB000477
Compound name:1-(3,4-Dimethoxyphenyl)ethanone
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Negative
Splash Key:splash10-052f-9700000000-7059250c1d2adb94be0f
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:40 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C10H12O3
Molecular Weight (Monoisotopic Mass):180.0786 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file748 Bytes
Peak assignments (TSV)Download file1.6 KB
mzML formatted file (MZML)Download file5 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 ]