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34,643 Hit.
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Name
Formula / Structure
ExactMass
ID
3',4'6,7-Tetrahydroxy-6-O-glucosylaurone, Mrtm-6-G...
6 spectra
C21H20O11
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
448.38000
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS085607
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS085608
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS085609
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS085610
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS085611
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS085612
3',5'-Cyclic AMP
9 spectra
C10H12N5O6P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
329.05252
LC-ESI-ITFT; MS2; m/z:134.05; NEG
MSBNK-NAIST-KNA00593
LC-ESI-ITFT; MS2; m/z:134.05; NEG
MSBNK-NAIST-KNA00797
LC-ESI-ITFT; MS2; m/z:328.04; NEG
MSBNK-NAIST-KNA00594
LC-ESI-ITFT; MS2; m/z:328.04; NEG
MSBNK-NAIST-KNA00798
LC-ESI-ITFT; MS2; m/z:657.10; NEG
MSBNK-NAIST-KNA00595
LC-ESI-ITFT; MS2; m/z:657.10; NEG
MSBNK-NAIST-KNA00799
LC-ESI-ITFT; MS; NEG
MSBNK-NAIST-KNA00592
LC-ESI-ITFT; MS; NEG
MSBNK-NAIST-KNA00796
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100531
3',5'-Cyclic CMP, cCMP, 4-amino-1-[(1S,6R,8R,9R)-3...
1 spectrum
C9H12N3O7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
305.18500
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT201890
3',5'-Cyclic CMP, cCMP, Cytidine-3',5'-cyclicmonop...
4 spectra
C9H12N3O7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
305.18500
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS018907
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS018908
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS018909
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS018910
3',5'-Cyclic deoxy-TMP, cdTMP, Deoxythymidine-3',5...
5 spectra
C10H13N2O7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
304.19699
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS035607
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS035608
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS035609
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS035611
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS035612
3',5'-Dimethoxy-4'-hydroxyacetophenone
12 spectra
C10H12O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
196.20200
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308181
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308183
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308185
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308187
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308189
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308191
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308193
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308196
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308198
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308200
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308202
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308760
3',5,7-Trihydroxy-4'-methoxy flavanone, (2S)-5,7-d...
1 spectrum
C16H14O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
302.28201
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT207800
3',5,7-Trihydroxy-4'-methoxy flavanone, Hesperetin
3 spectra
C16H14O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
302.28201
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS078007
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS078008
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS078009
3',7-Dimethoxy-3-hydroxyflavone
4 spectra
C17H14O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
298.08414
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01682
LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01692
LC-ESI-QTOF; MS2; CE 40 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01702
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80351
3'-Adenylic acid
1 spectrum
C10H14N5O7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
347.06308
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80366
3'-AMP
1 spectrum
C10H14N5O7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
347.06311
LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M-H]-
MSBNK-MetaboLights-ML001151
3'-Dephosphocoenzyme A
2 spectra
C21H35N7O13P2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
687.14886
LC-ESI-QTOF; MS2; CE:30 V; [M-H]-
MSBNK-RIKEN-PR100529
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100528
3'-Hydroxyflavone
5 spectra
C15H10O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
238.06300
LC-ESI-QTOF; MS
MSBNK-BS-BS003770
LC-ESI-QTOF; MS2; CE:10 eV; [M-H]-
MSBNK-BS-BS003771
LC-ESI-QTOF; MS2; CE:20 eV; [M-H]-
MSBNK-BS-BS003773
LC-ESI-QTOF; MS2; CE:30 eV; [M-H]-
MSBNK-BS-BS003772
LC-ESI-QTOF; MS2; CE:40 eV; [M-H]-
MSBNK-BS-BS003774
3(2'-Chlorophenyl)-7-hydroxy-4-phenylcoumarin
5 spectra
C21H13ClO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
348.05533
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80293
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01735
LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01742
LC-ESI-QTOF; MS2; CE 40 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01749
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80291
3,12-Dioxo-5a-cholan-24-oic acid
5 spectra
C24H36O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
388.26135
LC-ESI-TOF; MS; NEGATIVE; in source decay -120 V
MSBNK-Nihon_Univ-NU000729
LC-ESI-TOF; MS; NEGATIVE; in source decay -150 V
MSBNK-Nihon_Univ-NU000730
LC-ESI-TOF; MS; NEGATIVE; in source decay -30 V
MSBNK-Nihon_Univ-NU000726
LC-ESI-TOF; MS; NEGATIVE; in source decay -60 V
MSBNK-Nihon_Univ-NU000727
LC-ESI-TOF; MS; NEGATIVE; in source decay -90 V
MSBNK-Nihon_Univ-NU000728
3,12-Dioxo-5b-cholan-24-oic acid
5 spectra
C24H36O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
388.26135
LC-ESI-TOF; MS; NEGATIVE; in source decay -120 V
MSBNK-Nihon_Univ-NU000684
LC-ESI-TOF; MS; NEGATIVE; in source decay -150 V
MSBNK-Nihon_Univ-NU000685
LC-ESI-TOF; MS; NEGATIVE; in source decay -30 V
MSBNK-Nihon_Univ-NU000681
LC-ESI-TOF; MS; NEGATIVE; in source decay -60 V
MSBNK-Nihon_Univ-NU000682
LC-ESI-TOF; MS; NEGATIVE; in source decay -90 V
MSBNK-Nihon_Univ-NU000683
3,3',5-Triiodothyronine
5 spectra
C15H12I3NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
650.79004
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001913
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001914
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001915
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001916
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001917
3,3'-Dihydroxyflavone
5 spectra
C15H10O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
254.05791
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80313
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML00333
LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-
MSBNK-Washington_State_Univ-BML00338
LC-ESI-QTOF; MS2; CE 40 ev; [M-H]-
MSBNK-Washington_State_Univ-BML00343
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80311
3,3'-Sulphonyldianiline
3 spectra
C12H12N2O2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
248.06195
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001449
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001446
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001447
3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctane-1-su...
16 spectra
C8H5F13O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
427.97519
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111013856
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111013849
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111013851
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111013858
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111013854
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111013844
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111013857
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111013853
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111013852
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111013843
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111013855
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111013850
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111013846
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111013847
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111013845
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111013848
3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctyl dihyd...
16 spectra
C8H6F13O4P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
443.97961
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111013899
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111013893
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111013904
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111013900
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111013895
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111013892
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111013891
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111013906
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111013898
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111013896
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111013897
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111013905
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111013901
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111013902
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111013894
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111013903
3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluo...
16 spectra
C10H5F17O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
527.96881
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111013933
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111013923
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111013922
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111013924
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111013929
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111013927
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111013925
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111013931
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111013930
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111013920
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111013928
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111013932
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111013921
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111013934
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111013919
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111013926
3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluo...
16 spectra
C10H6F17O4P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
543.97321
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111013945
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111013936
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111013935
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111013944
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111013943
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111013939
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111013938
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111013947
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111013949
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111013937
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111013941
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111013940
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111013942
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111013950
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111013948
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111013946
3,3,5,5-Tetrabromobisphenol A
2 spectra
C15H12Br4O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
539.75708
LC-APCI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M-H]-
MSBNK-ACES_SU-AS000023
LC-ESI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M-H]-
MSBNK-ACES_SU-AS000218
3,3`,5,5`-Tetrabromobisphenol A
6 spectra
C15H12Br4O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
539.75708
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU049551
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU049552
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU049553
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU049554
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU049555
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU049556
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