NMRFAM Logo Computational Annotation of MS Peaks (CAMP)
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Atom-Mass pairs
Related entries (identical compound): OUF00489 PR100624 MT000100
Submission id: PR100624

Outputs for Xanthine; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-


Database: Plant Science Center, RIKEN
Entry ID: PR100624
Synonyms: Xanthine, XAN, 2,6-Dihydroxypurine, 2,6-Dioxo-1,2,3,6-tetrahydropurine, 2,6-Dioxopurine, Xanthic oxide
Total mass: 152.1107
Formula: H4 C5 O2 N4

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: UPLC Q-Tof Premier, Waters
Instrument type: LC-ESI-QTOF
Ionization: ESI
Ionization mode: NEGATIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks:
Processing time: 0:00:00.731760
Queried mass list: ['108.020', '151.026']



Queried massNum. matched formulasNum. matched fragments
108.0203 (link to fragments) 3 6
151.0256 (link to fragments) 1 1


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