Predicted LC-MS/MS Spectrum - 20V, Negative (M2MDB000833)
Spectrum Details
ECMDB ID: | ECMDB12249 |
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Compound name: | L-Aspartate-semialdehyde |
Spectrum type: | Predicted LC-MS/MS Spectrum - 20V, Negative |
Splash Key: | splash10-00di-9000000000-f667b7d456d3acb3e0f4 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: | C4H7NO3 |
Molecular Weight (Monoisotopic Mass): | 117.0426 Da |
Molecular Weight (Avergae Mass): | 117.1033 Da |
Documentation
Not Available
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 ]