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96,350 Hit.
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Name
Formula / Structure
ExactMass
ID
(8Z)-2,15-dioxapentacyclo[22.2.2.13,7.110,14.016,2...
3 spectra
C28H24O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
440.16199
LC-ESI-QTOF; MS2; CE: 30.58772; [M+H]+
MSBNK-IPB_Halle-PB011201
LC-ESI-QTOF; MS2; CE: 30.58772; [M+H]+
MSBNK-IPB_Halle-PB011401
LC-ESI-QTOF; MS2; CE: 30.58772; [M+H]+
MSBNK-IPB_Halle-PB011501
(9Z,12R)-12-Hydroxyoctadec-9-enoic acid
6 spectra
C18H34O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
298.25079
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU021951
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU021952
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU021953
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU021954
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU021955
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU021956
(Aminomethyl)phosphonic acid
10 spectra
CH6NO3P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
111.00853
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO002403
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO000305
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO002404
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO000306
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO002405
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO000307
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO002406
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO000308
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO002407
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO000309
(Benzothiazol-2-ylthio)methyl thiocyanate
9 spectra
C9H6N2S3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
237.96931
LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
MSBNK-UFZ-WANA098601AD6CPH
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
MSBNK-UFZ-WANA098603B085PH
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
MSBNK-UFZ-WANA098605070APH
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
MSBNK-UFZ-WANA098611C9CFPH
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
MSBNK-UFZ-WANA098613D9F1PH
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
MSBNK-UFZ-WANA0986155BE0PH
LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
MSBNK-UFZ-WANA0986213166PH
LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
MSBNK-UFZ-WANA0986237762PH
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
MSBNK-UFZ-WANA098625AF82PH
(Benzotriazol-1-yloxy)-tris(dimethylamino)phosphon...
10 spectra
[C12H22N6OP]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
297.15869
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL231109407
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL231109406
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL231109402
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL231109399
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL231109400
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL231109401
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL231109408
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL231109405
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL231109404
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL231109403
(Benzyloxycarbonylmethyl)triphenylphosphonium
16 spectra
[C27H24O2P]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
411.15079
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111014722
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111014712
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111014718
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111014711
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111014710
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111014723
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111014716
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111014715
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111014713
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111014708
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111014721
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111014720
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111014714
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111014717
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111014709
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111014719
(cis,trans)-Farnesyl acetate , 3,7,11-Trimethyl-2,...
2 spectra
C17H28O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
264.40900
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS089101
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS089103
(des-arg9)-Bradykinin
1 spectrum
C44H61N11O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
903.46027
LC-ESI-IT; MS2; m/z: 453.0; [M+2H]2+
MSBNK-Metabolon-MT000132
(Dodecyloxy)sulfonic acid
1 spectrum
C12H26O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
266.15518
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR309118
(E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid, tran...
2 spectra
C9H8O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
180.15900
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT101770
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT201770
(E)-3-(3,5-dimethoxyphenyl)prop-2-enoic acid, 3,5-...
1 spectrum
C11H12O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
208.21300
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT107610
(E)-3-(4-hydroxyphenyl)prop-2-enoic acid, trans-4-...
2 spectra
C9H8O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
164.16000
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT211430
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT211433
(E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methyl...
2 spectra
C18H27NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
305.41800
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT104410
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT204410
(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-ol,...
1 spectrum
C20H40O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
296.53900
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT100970
(E,E)-2,4-Decadienal
2 spectra
C10H16O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
152.12012
ESI-QTOF; MS2; CE: 10; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002295
ESI-QTOF; MS2; CE: 20; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002294
(Ethoxycarbonylmethyl)triphenylphosphonium
16 spectra
[C22H22O2P]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
349.13519
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111014965
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111014958
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111014954
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111014956
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111014967
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111014969
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111014955
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111014968
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111014964
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111014963
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111014966
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111014959
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111014957
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111014960
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111014961
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111014962
(gamma-Glu-Cys-Gly) (gamma-Glu-Cys-Gly)(Disulfide ...
3 spectra
C20H32N6O12S2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
612.63599
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT102350
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT102353
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT202350
(gamma-Glu-Cys-Gly) (gamma-Glu-Cys-Gly)(Disulfide ...
9 spectra
C20H32N6O12S2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
612.63599
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS023501
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS023502
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS023503
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS023505
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS023507
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS023508
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS023509
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS023510
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS023512
(Glc(alpha1-4)Glc(alpha1-4)Glc), (2R,3R,4S,5S,6R)-...
2 spectra
C18H32O16
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
504.43799
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT202950
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT205480
(Glc(alpha1-4)Glc(alpha1-4)Glc), Triomaltose, Amyl...
12 spectra
C18H32O16
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
504.43799
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS029501
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS029502
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS029503
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS029505
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS029506
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS054801
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS054802
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS054803
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS054804
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS054805
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS054807
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS054808
(Methoxycarbonylmethyl)triphenylphosphonium
16 spectra
[C21H20O2P]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
335.11951
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL231109863
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL231109850
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL231109860
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL231109862
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL231109853
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL231109854
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL231109861
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL231109857
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL231109855
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL231109851
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL231109859
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL231109848
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL231109856
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL231109858
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL231109852
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL231109849
(Methoxymethyl)diphenylphosphine oxide
16 spectra
C14H15O2P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
246.08099
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311095699
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL2311095695
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL2311095703
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL2311095696
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL2311095707
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL2311095692
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL2311095700
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311095697
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311095693
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311095701
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311095706
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311095698
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311095694
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311095702
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL2311095704
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL2311095705
(Methoxymethyl)triphenylphosphonium
18 spectra
[C20H20OP]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
307.12460
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111011521
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111011513
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111011519
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111011511
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111011520
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111011514
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111011518
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111011515
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111011507
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111011508
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111011512
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111011509
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111011510
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111011516
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111011517
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111011506
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU248503
LC-ESI-QTOF; MS2; CE: Ramp 21.8-32.6 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU248506
(Methylsulfanyl)butyl glucosinolate
1 spectrum
C12H23NO9S3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
421.50900
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR309205
(Methylsulfanyl)heptyl glucosinolate
1 spectrum
C15H29NO9S3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
463.59000
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR309210
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