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Spectrum Details
HMDB ID:HMDB0001330
Compound name:2-Amino-3-carboxymuconic acid semialdehyde
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Positive
Splash Key:splash10-014l-9100000000-fa0ffd8141b90a020246
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:C7H7NO5
Molecular Weight (Monoisotopic Mass):185.0324 Da
Documentation
Document DescriptionDownload
List of m/z values for the spectrum (TXT)Download file502 Bytes
Generated list of m/z values for the spectrum (TXT-20190109-20465-WQ97B0)Download file502 Bytes
mzML formatted file (MZML)Download file4.37 KB
References
  1. Allen F, Greiner R, Wishart D: Competitive fragmentation modeling of ESI-MS/MS spectra for putative metabolite identification. Metabolomics. 2015 11(1):98–110. doi: 10.1007/s11306-014-0676-4.