Spectrum Details
MiMe ID:MMDBc0017114
Compound name:1-(3-Methylphenyl)-ethanone
Spectrum type:Predicted LC-MS/MS Spectrum - 20V, Negative
Splash Key:splash10-000x-9600000000-e22a6b7267947158f689
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:20 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C9H10O
Molecular Weight (Monoisotopic Mass):134.0732 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file182 Bytes
Peak assignments (TSV)Download file384 Bytes
mzML formatted file (MZML)Download file4.25 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 ]