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Spectrum Details
HMDB ID:HMDB0031526
Compound name:(±)-2-Methylbutanal
Spectrum type:Predicted LC-MS/MS Spectrum - 20V, Negative
Splash Key:splash10-000i-9000000000-f57c47d0ebb97da44ae3 View in MoNA
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:C5H10O
Molecular Weight (Monoisotopic Mass):86.0732 Da
Molecular Weight (Avergae Mass):86.1323 Da
Documentation
Document DescriptionDownload
List of m/z values for the spectrumDownload file
mzML formatted fileDownload file
References
  1. Allen, F., Greiner, R., Allen, F. (2015) Competitive fragmentation modeling of ESI-MS/MS spectra for putative metabolite identification. Metabolomics. 11(1):98–110