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33,706 Hit.
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Name
Formula / Structure
ExactMass
ID
Torasemide
21 spectra
C16H20N4O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
348.12561
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM819252
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL231109913
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL231109921
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL231109925
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL231109917
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL231109915
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL231109916
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL231109927
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL231109920
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL231109926
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL231109914
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL231109919
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL231109918
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL231109922
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL231109912
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL231109923
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL231109924
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU236557
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU236558
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU236559
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU236560
Torsemide
6 spectra
C16H20N4O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
348.12561
LC-ESI-QFT; MS2; CE: 15; R=35000; [M-H]-
MSBNK-Eawag-EQ314551
LC-ESI-QFT; MS2; CE: 30; R=35000; [M-H]-
MSBNK-Eawag-EQ314552
LC-ESI-QFT; MS2; CE: 45; R=35000; [M-H]-
MSBNK-Eawag-EQ314553
LC-ESI-QFT; MS2; CE: 60; R=35000; [M-H]-
MSBNK-Eawag-EQ314554
LC-ESI-QFT; MS2; CE: 75; R=35000; [M-H]-
MSBNK-Eawag-EQ314555
LC-ESI-QFT; MS2; CE: 90; R=35000; [M-H]-
MSBNK-Eawag-EQ314556
Tralkoxydim
7 spectra
C20H27NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
329.19910
LC-ESI-QTOF; MS2; ESI; NEGATIVE; [M-H]-; CE 10 V
MSBNK-MSSJ-MSJ02218
LC-ESI-QTOF; MS2; ESI; NEGATIVE; [M-H]-; CE 20 V
MSBNK-MSSJ-MSJ02219
LC-ESI-QTOF; MS2; ESI; NEGATIVE; [M-H]-; CE 30 V
MSBNK-MSSJ-MSJ02220
LC-ESI-QTOF; MS2; ESI; NEGATIVE; [M-H]-; CE 40 V
MSBNK-MSSJ-MSJ02221
LC-ESI-QTOF; MS2; ESI; NEGATIVE; [M-H]-; CE 50 V
MSBNK-MSSJ-MSJ02222
LC-ESI-QTOF; MS2; ESI; NEGATIVE; [M-H]-; CE 60 V
MSBNK-MSSJ-MSJ02223
LC-ESI-QTOF; MS; ESI; NEGATIVE
MSBNK-MSSJ-MSJ02217
Tralkoxydim (isomer1)
6 spectra
C20H27NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
329.19910
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Waters-WA000094
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Waters-WA000095
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Waters-WA000096
LC-ESI-QQ; MS2; CE:60 V; [M-H]-
MSBNK-Waters-WA000097
LC-ESI-QQ; MS2; CE:70 V; [M-H]-
MSBNK-Waters-WA000098
LC-ESI-QQ; MS2; CE:80 V; [M-H]-
MSBNK-Waters-WA000099
Tralopyril
8 spectra
C12H5BrClF3N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
347.92767
ESI-QTOF; MS2; NEGATIVE; [M-H]-; 81Br-isotopolog ion; CID; 10 V
MSBNK-MSSJ-MSJ00785
ESI-QTOF; MS2; NEGATIVE; [M-H]-; 81Br-isotopolog ion; CID; 20 V
MSBNK-MSSJ-MSJ00786
ESI-QTOF; MS2; NEGATIVE; [M-H]-; 81Br-isotopolog ion; CID; 30 V
MSBNK-MSSJ-MSJ00787
ESI-QTOF; MS2; NEGATIVE; [M-H]-; 81Br-isotopolog ion; CID;40 V
MSBNK-MSSJ-MSJ00788
ESI-QTOF; MS2; NEGATIVE; [M-H]-; 81Br-isotopolog ion; CID;50 V
MSBNK-MSSJ-MSJ00789
ESI-QTOF; MS2; NEGATIVE; [M-H]-; 81Br-isotopolog ion; CID;60 V
MSBNK-MSSJ-MSJ00790
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID;40 V
MSBNK-MSSJ-MSJ00791
ESI-QTOF; MS; NEGATIVE
MSBNK-MSSJ-MSJ00784
Trametenolic acid
7 spectra
C30H48O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
456.36035
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 10 V
MSBNK-MSSJ-MSJ00412
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 20 V
MSBNK-MSSJ-MSJ00413
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 30 V
MSBNK-MSSJ-MSJ00414
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 50 V
MSBNK-MSSJ-MSJ00416
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 60 V
MSBNK-MSSJ-MSJ00417
ESI-QTOF; MS2; POSITIVE; [M-H]-; CID; 40 V
MSBNK-MSSJ-MSJ00415
ESI-QTOF; MS; NEGATIVE
MSBNK-MSSJ-MSJ00411
trans-2-Hexenoic acid
9 spectra
C6H10O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
114.06810
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311091819
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311091816
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311091814
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311091815
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311091817
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311091820
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311091818
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311091822
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL2311091821
trans-2-Methyl-2-butenedioic acid, (E)-2-methylbut...
1 spectrum
C5H6O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
130.09900
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT200930
trans-3-Phenylacrylic acid, trans-Cinnamic acid, t...
1 spectrum
C9H8O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
148.16100
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT201050
trans-4-Coumaric acid
12 spectra
C9H8O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
164.16000
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305526
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305529
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305532
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305535
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305538
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305541
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305544
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305547
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305550
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305553
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305556
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305559
trans-4-Hydroxy-3-methoxycinnamate
6 spectra
C10H10O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
194.05791
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001106
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001107
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001108
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001109
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001110
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100482
trans-4-Hydroxy-L-proline
1 spectrum
C5H9NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
131.05824
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100613
trans-4-hydroxycinnamic acid, 4-Coumaric acid
3 spectra
C9H8O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
164.16000
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS045107
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS045108
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS045109
trans-4-hydroxycinnamic acid, 4-Coumaric acid, (E)...
1 spectrum
C9H8O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
164.16000
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT204510
trans-4-Hydroxycinnamic acid, p-Coumaric acid
3 spectra
C9H8O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
164.16000
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS114307
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS114308
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS114309
trans-Aconitate, trans-Aconitic acid, Citridic Aci...
1 spectrum
C6H6O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
174.10800
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT210110
trans-Aconitate, trans-Aconitic acid, Citridic Aci...
2 spectra
C6H6O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
174.10800
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS101107
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS101108
trans-Aconitic acid
6 spectra
C6H6O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
174.01643
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO000171
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO000172
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO000173
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO000174
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO000175
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100861
trans-Caffeate, 3,4-Dihydroxybenzeneacrylic acid, ...
6 spectra
C9H8O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
180.15900
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS017707
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS017708
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS017709
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS044607
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS044608
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS044609
trans-Caffeic acid
11 spectra
C9H8O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
180.15900
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307093
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307096
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307098
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307103
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307106
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307109
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307114
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307117
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307120
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307123
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR309377
trans-Cinnamic acid
16 spectra
C9H8O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
148.05243
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO000401
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO000402
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO000403
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO000404
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO000405
LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-METOX_N109828_B8BB
Trans-Cinnamic acid
2 spectra
C9H8O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
148.05240
LC-ESI-QTOF; MS2; CE: 10; R=; [M-H]-
MSBNK-BGC_Munich-RP018311
LC-ESI-QTOF; MS2; CE: 20; R=; [M-H]-
MSBNK-BGC_Munich-RP018312
trans-Cinnamic acid
16 spectra
C9H8O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
148.16100
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307042
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307044
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307046
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307049
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307051
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307054
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307056
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307058
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308807
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100513
trans-Ferulic acid
11 spectra
C10H10O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
194.18600
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307149
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307151
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307153
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307156
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307158
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307160
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307162
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307164
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307166
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307168
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR309325
trans-piceid
25 spectra
C20H22O8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
390.38800
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308287
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308288
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308290
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308291
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308293
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308294
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308296
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308297
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308299
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308300
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308301
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308303
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308304
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308306
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308307
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308309
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308310
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308311
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308312
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308314
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308315
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308317
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308318
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308716
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308966
trans-pterostilbene
13 spectra
C16H16O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
256.30099
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308319
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308320
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308321
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308322
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308323
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308324
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308325
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308326
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308327
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308328
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308329
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308330
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308718
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