Predicted LC-MS/MS Spectrum - 10V, Positive (HMDB0062666)
Spectrum Details
| HMDB ID: | HMDB0062666 | 
|---|---|
| Compound name: | Triethylene Glycol Monomethyl Ether | 
| Spectrum type: | Predicted LC-MS/MS Spectrum - 10V, Positive | 
| Splash Key: | splash10-014i-2900000000-42e7c0b43d669dfe658a | 
| 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: | C7H16O4 | 
| Molecular Weight (Monoisotopic Mass): | 164.1049 Da | 
Documentation
| Document Description | Download | |
|---|---|---|
| List of m/z values for the spectrum (TXT) | Download file | 757 Bytes | 
| Generated list of m/z values for the spectrum (TXT-20190109-20465-1FEEOWI) | Download file | 757 Bytes | 
| mzML formatted file (MZML) | Download file | 4.57 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.