Predicted LC-MS/MS Spectrum
Spectrum Details
| Compound Name: | 4-Octanone |
|---|---|
| Spectrum Type: | Predicted LC-MS/MS Spectrum |
| Splash Key: | splash10-004u-9400000000-0e802e36a36fab914ced |
Spectrum View
Experimental Conditions
| Ionization Mode: | Positive |
|---|---|
| Collision Energy: | med |
| Collision Energy (V): | 20 |
Notes
Predicted by CFM-ID
Documentation
| Document Description | Download |
|---|---|
| List of m/z values for the spectrum (TXT) | Download file |
| Generated list of m/z values for the spectrum (TXT) | 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.
Structure
