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Predicted LC-MS/MS Spectrum - 20V, Negative (YMDB00149)
Spectrum Details
YMDB ID: | YMDB00149 |
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Compound name: | 2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-ol |
Spectrum type: | Predicted LC-MS/MS Spectrum - 20V, Negative |
Splash Key: | splash10-0006-1900000000-695ce544726c989be876 View in MoNA |
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: | Negative |
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Collision Energy: | 20 eV |
Instrument Type: | QTOF (generic), spectrum predicted by CFM-ID |
Mass Resolution: | 0.0001 Da |
Molecular Formula: | C7H9N5O2 |
Molecular Weight (Monoisotopic Mass): | 195.0756 Da |
Molecular Weight (Avergae Mass): | 195.1787 Da |
Documentation
Document Description | Download |
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Generated list of m/z values for the spectrum | Download file |
Peak assignments | Download file |
mzML formatted file | Download file |
References
- Wang F, Liigand J, Tian S, Arndt D, Greiner R, and Wishart D. CFM-ID 4.0: More Accurate ESI MS/MS Spectral Prediction and Compound Identification. Analytical Chemistry202193 (34), 11692-11700 DOI: 10.1021/acs.analchem.1c01465 [PubMed: 34403256 ]