Predicted LC-MS/MS Spectrum - 20V, Negative (LMDB00306)
Spectrum Details
LMDB ID: | LMDB00306 |
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Compound name: | Allantoic acid |
Spectrum type: | Predicted LC-MS/MS Spectrum - 20V, Negative |
Splash Key: | splash10-0a5i-9400000000-6faaacd64e9faecfb1bf |
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 |
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Collision Energy: | 20 eV |
Instrument Type: | QTOF (generic), spectrum predicted by CFM-ID |
Mass Resolution: | 0.0001 Da |
Molecular Formula: | C4H8N4O4 |
Molecular Weight (Monoisotopic Mass): | 176.0546 Da |
Molecular Weight (Avergae Mass): | 176.1307 Da |
Documentation
Document Description | Download |
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List of m/z values for the spectrum | Download file |
Generated list of m/z values for the spectrum | Download file |
mzML formatted file | Download file |
References
- 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.