Predicted LC-MS/MS Spectrum - 40V, Positive (HMDB0041006)
Spectrum Details
| HMDB ID: | HMDB0041006 | 
|---|---|
| Compound name: | 1'-Acetoxychavicol | 
| Spectrum type: | Predicted LC-MS/MS Spectrum - 40V, Positive | 
| Splash Key: | splash10-001j-1900000000-962bbdcd8eeb60b29c29 | 
| 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: | C13H14O4 | 
| Molecular Weight (Monoisotopic Mass): | 234.0892 Da | 
Documentation
| Document Description | Download | |
|---|---|---|
| List of m/z values for the spectrum (TXT) | Download file | 429 Bytes | 
| Generated list of m/z values for the spectrum (TXT-20190109-20465-11SLS06) | Download file | 429 Bytes | 
| mzML formatted file (MZML) | Download file | 4.3 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.