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677 Hit.
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Name
Formula / Structure
ExactMass
ID
Glutamic acid
4 spectra
C5H9NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
147.05316
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-IPB_Halle-PB000461
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB000462
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB000463
LC-ESI-QTOF; MS2; CE:30 eV; [M+H]+
MSBNK-IPB_Halle-PB000464
Glutamine
4 spectra
C5H10N2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
146.06914
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-IPB_Halle-PB000465
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB000466
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB000467
LC-ESI-QTOF; MS2; CE:30 eV; [M+H]+
MSBNK-IPB_Halle-PB000468
Glycine-Betaine
2 spectra
C5H11NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
117.07898
LC-ESI-QQ; MS2; CE:20 eV; M+
MSBNK-IPB_Halle-PB001708
LC-ESI-QQ; MS2; CE:25 eV; M+
MSBNK-IPB_Halle-PB001709
Harman
2 spectra
C12H10N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
182.08440
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB000886
LC-ESI-QTOF; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB000901
Harmane
6 spectra
C12H10N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
182.08440
LC-ESI-QQ; MS2; CE:35 eV; [M+H]+
MSBNK-IPB_Halle-PB003741
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-IPB_Halle-PB005765
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB005781
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB005782
LC-ESI-QTOF; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB005783
LC-ESI-QTOF; MS2; CE:30 eV; [M+H]+
MSBNK-IPB_Halle-PB005784
Hesperidin methyl chalcone
3 spectra
C29H36O15
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
624.20544
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-IPB_Halle-PB006241
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB006242
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB006243
Histidine
4 spectra
C6H9N3O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
155.06947
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB000422
LC-ESI-QTOF; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB000423
LC-ESI-QTOF; MS2; CE:35 eV; [M+H]+
MSBNK-IPB_Halle-PB000424
LC-ESI-QTOF; MS2; CE:45 eV; [M+H]+
MSBNK-IPB_Halle-PB000425
IAA-Val , Indole-3-acetyl-L-valine
3 spectra
C15H18N2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
274.13174
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-IPB_Halle-PB005788
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB005789
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB005790
Indole-3-acetonitrile
3 spectra
C10H8N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
156.06876
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-IPB_Halle-PB006044
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB006045
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB006046
Indole-3-acetyl-L-valine
4 spectra
C15H18N2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
274.13174
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB000551
LC-ESI-QTOF; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB000552
LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
MSBNK-IPB_Halle-PB000553
LC-ESI-QTOF; MS2; CE:55 eV; [M+H]+
MSBNK-IPB_Halle-PB000554
Indole-3-carbinol
3 spectra
C9H9NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
147.06841
LC-ESI-QTOF; MS2; CE:20 eV; [M+H-H2O]+
MSBNK-IPB_Halle-PB000515
LC-ESI-QTOF; MS2; CE:30 eV; [M+H-H2O]+
MSBNK-IPB_Halle-PB000516
LC-ESI-QTOF; MS2; CE:40 eV; [M+H-H2O]+
MSBNK-IPB_Halle-PB000517
Indole-3-carboxylic acid
3 spectra
C9H7NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
161.04768
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-IPB_Halle-PB005785
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB005786
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB005787
Indoleacetic acid
5 spectra
C10H9NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
175.06332
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-IPB_Halle-PB000510
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB000511
LC-ESI-QTOF; MS2; CE:30 eV; [M+H]+
MSBNK-IPB_Halle-PB000512
LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
MSBNK-IPB_Halle-PB000513
LC-ESI-QTOF; MS2; CE:50 eV; [M+H]+
MSBNK-IPB_Halle-PB000514
Isoleucine
4 spectra
C6H13NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
131.09464
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-IPB_Halle-PB000395
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB000396
LC-ESI-QTOF; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB000397
LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
MSBNK-IPB_Halle-PB000398
Isovitexin
2 spectra
C21H20O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
432.10565
ESI-TOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PN000123
ESI-TOF; MS2; CE:25 eV; [M-H]-
MSBNK-IPB_Halle-PN000122
Kaempferol
15 spectra
C15H10O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
286.04773
LC-ESI-QQ; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB004121
LC-ESI-QQ; MS2; CE:30 eV; [M+H]+
MSBNK-IPB_Halle-PB004122
LC-ESI-QQ; MS2; CE:30 eV; [M-H]-
MSBNK-IPB_Halle-PB004141
LC-ESI-QQ; MS2; CE:35 eV; [M+H]+
MSBNK-IPB_Halle-PB004123
LC-ESI-QQ; MS2; CE:35 eV; [M-H]-
MSBNK-IPB_Halle-PB004142
LC-ESI-QQ; MS2; CE:40 eV; [M-H]-
MSBNK-IPB_Halle-PB004143
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-IPB_Halle-PB005702
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB000164
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB005703
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB005704
LC-ESI-QTOF; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB000165
LC-ESI-QTOF; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB005705
LC-ESI-QTOF; MS2; CE:30 eV; [M+H]+
MSBNK-IPB_Halle-PB005706
LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
MSBNK-IPB_Halle-PB000166
LC-ESI-QTOF; MS2; CE:55 eV; [M+H]+
MSBNK-IPB_Halle-PB000167
Kaempferol O-glucoside malonylated
1 spectrum
C24H22O14
534.10095
ESI-TOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PN000063
Kaempferol-3-O-glucoside
1 spectrum
C21H20O11
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
448.10056
ESI-TOF; MS2; CE:25 eV; [M-H]-
MSBNK-IPB_Halle-PN000124
Kaempferol-7-O-glucoside
2 spectra
C21H20O11
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
448.10056
ESI-TOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PN000114
ESI-TOF; MS2; CE:25 eV; [M-H]-
MSBNK-IPB_Halle-PN000115
Kaempferol-7-O-neohesperidoside
2 spectra
C27H30O15
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
594.15845
ESI-TOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PN000125
ESI-TOF; MS2; CE:25 eV; [M-H]-
MSBNK-IPB_Halle-PN000126
Keampferol
2 spectra
C15H10O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
286.04773
ESI-TOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PN000001
ESI-TOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PN000002
Kinetin
7 spectra
C10H9N5O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
215.08070
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-IPB_Halle-PB005861
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB000627
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB005862
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB005863
LC-ESI-QTOF; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB000628
LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
MSBNK-IPB_Halle-PB000629
LC-ESI-QTOF; MS2; CE:55 eV; [M+H]+
MSBNK-IPB_Halle-PB000630
Laudanosine
3 spectra
C21H27NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
357.19400
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-IPB_Halle-PB005864
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB005881
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB005882
Leucine
3 spectra
C6H13NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
131.09464
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB000392
LC-ESI-QTOF; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB000393
LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
MSBNK-IPB_Halle-PB000394
Luteolin
6 spectra
C15H10O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
286.04773
ESI-TOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PN000113
ESI-TOF; MS2; CE:25 eV; [M-H]-
MSBNK-IPB_Halle-PN000112
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB000741
LC-ESI-QTOF; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB000742
LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
MSBNK-IPB_Halle-PB000743
LC-ESI-QTOF; MS2; CE:55 eV; [M+H]+
MSBNK-IPB_Halle-PB000744
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