Predicted LC-MS/MS Spectrum - 20V, Positive (HMDB0061000)
Spectrum Details
HMDB ID: | HMDB0061000 |
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Compound name: | 4-(4-Chlorophenyl)-1-[4-(4-fluorophenyl)-4-oxobutyl]-pyridinium (HPP+) |
Spectrum type: | Predicted LC-MS/MS Spectrum - 20V, Positive |
Splash Key: | splash10-0uxr-0915000000-87ef5dcde95f33671a5a |
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 |
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Collision Energy: | 20 eV |
Instrument Type: | QTOF (generic), spectrum predicted by CFM-ID |
Mass Resolution: | 0.0001 Da |
Molecular Formula: | C21H18ClFNO |
Molecular Weight (Monoisotopic Mass): | 354.1061 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 ]