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Atom-Mass pairs
Related entries (identical compound): KO009020 BML81550 BML81551 FIO00640 FIO00641 FIO00642 KO003269 KO003268 KO003267 KO009016 KO009017 KO009019 MT000014 FIO00639 FIO00638 OUF00313 KO009018 KO003270 KO003271
Submission id: FIO00640

Outputs for Kynurenine; LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV


Database: Natural Product Chemistry Lab (CPqRR/FIOCRUZ, Brazil)
Entry ID: FIO00640
Synonyms: Kynurenine
Total mass: 208.2134
Formula: H12 C10 O3 N2

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: maXis (Bruker Daltonics)
Instrument type: LC-ESI-QTOF
Ionization: ESI
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 92.0495, 95.0677, 118.0648, 119.068, 121.0474, 133.0474, 136.0753, 147.0631, 175.0573,
Processing time: 0:00:01.784367
Queried mass list: ['91.055', '94.065', '99.007', '104.049', '117.056', '120.044', '128.049', '132.044', '135.023', '137.079', '146.060', '150.055', '174.055']



Queried massNum. matched formulasNum. matched fragments
91.055 (link to fragments) 6 59
94.065 (link to fragments) 7 41
99.0074 (link to fragments) 6 50
104.0492 (link to fragments) 8 71
117.056 (link to fragments) 2 2
120.0441 (link to fragments) 2 2
128.0495 (link to fragments) 2 2
132.0443 (link to fragments) 1 1
135.0228 (link to fragments) 2 2
137.0788 (link to fragments) 1 1
146.0599 (link to fragments) 1 1
150.0549 (link to fragments) 2 2
174.055 (link to fragments) 1 3


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