Predicted LC-MS/MS Spectrum - 20V, Positive (MMDBc0033278)
Spectrum Details
| MiMe ID: | MMDBc0033278 | 
|---|---|
| Compound name: | PC(18:0/18:0) | 
| Spectrum type: | Predicted LC-MS/MS Spectrum - 20V, Positive | 
| Splash Key: | splash10-000x-0600000900-cbf5b5700da15bd27faf | 
| 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: | 20 eV | 
| Instrument Type: | QTOF (generic), spectrum predicted by CFM-ID | 
| Mass Resolution: | 0.0001 Da | 
| Molecular Formula: | C44H88NO8P | 
| Molecular Weight (Monoisotopic Mass): | 789.6248 Da | 
Documentation
| Document Description | Download | |
|---|---|---|
| List of m/z values for the spectrum (TXT) | Download file | 30 Bytes | 
| Generated list of m/z values for the spectrum (TXT-20190109-20465-1A204IH) | Download file | 30 Bytes | 
| mzML formatted file (MZML) | Download file | 3.97 KB | 
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.