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33,706 Hit.
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Name
Formula / Structure
ExactMass
ID
2-Benzothiazolsulfonic acid
4 spectra
C7H5NO3S2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
214.97110
LC-ESI-ITFT; MS2; CE: 35; R=15000; [M-H]-
MSBNK-UFZ-UF420953
LC-ESI-ITFT; MS2; CE: 55; R=15000; [M-H]-
MSBNK-UFZ-UF420951
LC-ESI-ITFT; MS2; CE: 55; R=15000; [M-H]-
MSBNK-UFZ-UF420954
LC-ESI-ITFT; MS2; CE: 80; R=15000; [M-H]-
MSBNK-UFZ-UF420952
2-Benzyl-4-chlorophenol
17 spectra
C13H11ClO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
218.04980
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM814053
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111011960
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111011955
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111011954
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111011953
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111011951
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111011959
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111011947
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111011952
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111011948
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111011956
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111011961
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111011957
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111011946
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111011949
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111011950
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111011958
2-Bromo-4,6-dinitroaniline
2 spectra
C6H4BrN3O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
260.93851
LC-APCI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M-H]-
MSBNK-ACES_SU-AS000019
LC-ESI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M-H]-
MSBNK-ACES_SU-AS000216
2-Carboxybenzaldehyde
4 spectra
C8H6O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
150.03169
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO000437
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO000438
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO000439
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO000440
2-Chloro-4-nitroaniline
3 spectra
C6H5ClN2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
172.00395
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000516
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000515
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000514
2-Chloro-4-nitrobenzamide
4 spectra
C7H5ClN2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
199.99890
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU028453
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU028454
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU028455
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU028456
2-Chloro-4-phenylphenol
6 spectra
C12H9ClO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
204.03419
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU104851
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU104852
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU104853
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU104854
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU104855
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU104856
2-Chloro-5-nitro-N-phenylbenzamide
7 spectra
C13H9ClN2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
276.03018
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001514
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001513
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001511
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU092951
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU092952
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU092953
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU092954
2-Chloro-5-nitroaniline
3 spectra
C6H5ClN2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
172.00395
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000045
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000044
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000043
2-Chloro-N-(2-methyl-4-bromophenyl)acetamide
3 spectra
C9H9BrClNO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
260.95560
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001700
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001699
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001701
2-Chloro-N-phenylacetamide
3 spectra
C8H8ClNO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
169.02943
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000242
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000241
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000243
2-Chlorobenzenesulfonamide
6 spectra
C6H6ClNO2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
190.98080
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU026351
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU026352
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU026353
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU026354
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU026355
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU026356
2-Chlorobenzoic acid
5 spectra
C7H5ClO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
155.99780
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO000481
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO000482
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO000483
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO000484
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO000485
2-Coumaric acid
6 spectra
C9H8O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
164.04733
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO000441
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO000442
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO000443
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO000444
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO000445
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100593
2-Deoxycrustecdysone
4 spectra
C27H44O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
464.64810
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA03471
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA03470
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA03469
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA03472
2-Deoxyglucose 6-phosphate
5 spectra
C6H13O8P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
244.03481
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO000654
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO000655
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO000656
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO000657
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO000658
2-Deoxyribose 1-phosphate
5 spectra
C5H11O7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
214.02425
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO000549
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO000550
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO000551
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO000552
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO000553
2-Deoxyribose 5-phosphate
6 spectra
C5H11O7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
214.02425
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO000564
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO000565
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO000566
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO000567
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO000568
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100525
2-Ethyl-4-hydroxyhexylsalicylate
6 spectra
C15H22O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
266.15179
LC-ESI-QTOF; MS2; CE: 10eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116326
LC-ESI-QTOF; MS2; CE: 15eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116327
LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116328
LC-ESI-QTOF; MS2; CE: 25eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116329
LC-ESI-QTOF; MS2; CE: 30eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116330
LC-ESI-QTOF; MS2; CE: 5eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116325
2-Ethyl-oxo-hexylsalicylate
12 spectra
C15H20O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
264.13620
LC-ESI-QTOF; MS2; CE: 10eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116126
LC-ESI-QTOF; MS2; CE: 15eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116127
LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116128
LC-ESI-QTOF; MS2; CE: 25eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116129
LC-ESI-QTOF; MS2; CE: 30eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116130
LC-ESI-QTOF; MS2; CE: 35eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116131
LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116132
LC-ESI-QTOF; MS2; CE: 45eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116133
LC-ESI-QTOF; MS2; CE: 50eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116134
LC-ESI-QTOF; MS2; CE: 55eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116135
LC-ESI-QTOF; MS2; CE: 5eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116125
LC-ESI-QTOF; MS2; CE: 60eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN116136
2-Ethylhexyl cyanoacetate
3 spectra
C11H19NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
197.14159
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000662
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000663
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000661
2-Ethylhexyl dihydrogen phosphate
3 spectra
C8H19O4P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
210.10210
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000860
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000859
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000861
2-Ethylhexyl sulfate
3 spectra
C8H18O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
210.09258
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002370
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002368
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002369
2-Ethylhexylparaben
3 spectra
C15H22O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
250.15689
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001039
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001038
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001037
2-formylbenzenesulfonate
6 spectra
C7H6O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
185.99870
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU076651
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU076652
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU076653
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU076654
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU076655
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU076656
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