Related entries (identical compound): BML81545 BML81547 BML81546 FIO00652 FIO00651 FIO00650 BML00236 BML00250 FIO00648 FIO00643 FIO00644 FIO00645 FIO00646 FIO00647 OUF00292 FIO00649 GLS00094 BML00243 PR100406 PR100864 BML81548

Submission id: FIO00646

Outputs for Kynurenic acid; LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV

Database: Natural Product Chemistry Lab (CPqRR/FIOCRUZ, Brazil)
Entry ID: FIO00646
Synonyms: Kynurenic acid
Total mass: 189.1672
Formula: H7 C10 O3 N1

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: 90.0418, 117.0524, 145.0475, 163.0585,
Processing time: 0:00:01.601134
Queried mass list: ['89.038', '116.049', '129.045', '134.060', '144.044', '154.040', '162.055']

Queried mass	Num. matched formulas	Num. matched fragments
89.0381 (link to fragments)	4	85
116.0494 (link to fragments)	1	1
129.0446	No match found!	No match found!
134.0602	No match found!	No match found!
144.0444	No match found!	No match found!
154.0401	No match found!	No match found!
162.055	No match found!	No match found!