Predicted LC-MS/MS Spectrum - 10V, Positive (HMDB0241555)
Spectrum Details
| HMDB ID: | HMDB0241555 |
|---|---|
| Compound name: | (10E,12E,14E)-9-Hydroxy-16-oxooctadeca-10,12,14-trienoylcarnitine |
| Spectrum type: | Predicted LC-MS/MS Spectrum - 10V, Positive |
| Splash Key: | Not Available |
| 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: | 10 eV |
| Instrument Type: | QTOF (generic), spectrum predicted by CFM-ID |
| Mass Resolution: | 0.0001 Da |
| Molecular Formula: | C25H41NO6 |
| Molecular Weight (Monoisotopic Mass): | 451.2934 Da |
Documentation
| Document Description | Download | |
|---|---|---|
| Generated list of m/z values for the spectrum (TSV) | Download file | 86 Bytes |
| Peak assignments (TSV) | Download file | 244 Bytes |
| mzML formatted file (MZML) | Download file | 4.01 KB |
References
- Fei Wang, Jaanus Liigand, Siyang Tian, David Arndt, Russell Greiner, David S. Wishart. CFM-ID 4.0: More Accurate ESI MS/MS Spectral Prediction and Compound Identification (Submitted)