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33,706 Hit.
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Name
Formula / Structure
ExactMass
ID
1,2-Benzenediol, o-Benzenediol, o-Diphenol, 1,2-di...
2 spectra
C6H6O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
110.11200
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT203940
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT203943
1,2-Benzisothiazol-3(2H)-one
15 spectra
C7H5NOS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
151.00920
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111015873
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111015867
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111015866
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111015868
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111015876
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111015870
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111015874
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111015872
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111015871
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111015877
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111015875
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111015864
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111015865
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111015869
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111015863
1,2-Di-O-sinapoyl-beta-D-glucose
1 spectrum
C28H32O14
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
592.17902
LC-ESI-QTOF; MS2; CE:20 eV;
MSBNK-CASMI_2012-SMI00021
1,2-diheptadecanoyl-sn-glycero-3-phosphate
3 spectra
C37H73O8P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
676.50427
LC-ESI-QTOF; MS2; CE: 10eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-METOX_N107127_9CB7
LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-METOX_N107126_B8BB
LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-METOX_N107127_9C9C
1,2-diheptadecanoyl-sn-glycero-3-phosphocholine
3 spectra
C42H84NO8P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
761.59351
LC-ESI-QTOF; MS2; CE: 10eV; R=7000; [M+CH3COO]-
MSBNK-Antwerp_Univ-METOX_N107432_3B51
LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M+CH3COO]-
MSBNK-Antwerp_Univ-METOX_N107432_D0B8
LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M+CH3COO]-
MSBNK-Antwerp_Univ-METOX_N107432_187B
1,2-dihexadecanoyl-sn-glycero-3-phosphoethanolamin...
3 spectra
C37H74NO8P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
691.51520
LC-ESI-QTOF; MS2; CE: 10eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-METOX_N107926_9CB7
LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-METOX_N107926_B8BB
LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-METOX_N107926_9C9C
1,2-Dilauroyl-sn-glycero-3-phosphate
1 spectrum
C27H53O8P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
536.34784
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100783
1,2-Dioleoyl-sn-glycero-3-phosphocholine
3 spectra
C44H84NO8P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
785.59351
LC-ESI-QTOF; MS2; CE: 10eV; R=7000; [M+CH3COO]-
MSBNK-Antwerp_Univ-METOX_N107531_3B51
LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M+CH3COO]-
MSBNK-Antwerp_Univ-METOX_N107531_D0B8
LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M+CH3COO]-
MSBNK-Antwerp_Univ-METOX_N107531_187B
1,2-Dipalmitoyl-rac-glycerol
3 spectra
C35H68O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
568.50671
LC-ESI-QTOF; MS2; CE: 10eV; R=7000; [M+CH3COO]-
MSBNK-Antwerp_Univ-METOX_N103831_3B51
LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M+CH3COO]-
MSBNK-Antwerp_Univ-METOX_N103831_D0B8
LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M+CH3COO]-
MSBNK-Antwerp_Univ-METOX_N103831_187B
1,2-dipalmitoylphosphatidylglycerol , (16:0/16:0)P...
6 spectra
C38H75O10P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
722.98401
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS052007
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS052008
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS052009
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS052010
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS052011
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS052012
1,2-dipentadecanoyl-sn-glycero-3-phospho-(1-sn-gly...
3 spectra
C36H71O10P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
694.47852
LC-ESI-QTOF; MS2; CE: 10eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-METOX_N108226_9CB7
LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-METOX_N108226_B8BB
LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-METOX_N108226_9C9C
1,2-Propanedicarboxylic acid, 2-Methylbutanedioic ...
2 spectra
C5H8O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
132.11501
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS096207
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS096208
1,3-Benzenedicarboxylic acid, dihydrazide
3 spectra
C8H10N4O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
194.08037
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001502
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001505
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001504
1,3-Cyclohexanedione
3 spectra
C6H8O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
112.05243
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001284
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001288
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001286
1,3-Dicaffeoylquinic acid
1 spectrum
C25H24O12
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
516.45502
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PM000305
1,3-Dihydroxyacetone dimer
1 spectrum
C6H12O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
180.06339
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100844
1,3-Dihydroxyanthraquinone
1 spectrum
C14H8O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
240.04227
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM827751
1,3-dihydroxypropan-2-yl dihydrogen phosphate, Gly...
1 spectrum
C3H9O6P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
172.07500
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT207830
1,3-Diiminobenz(f)isoindoline
3 spectra
C12H9N3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
195.07965
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002434
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002431
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002435
1,3-dimethyl-7,9-dihydropurine-2,6,8-trione, 1,3-D...
2 spectra
C7H8N4O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
196.16600
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT210290
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT210293
1,3-Dimethylurate, Oxytheophylline, 1,3-Dimethyl-2...
2 spectra
C7H8N4O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
196.16600
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS102907
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS102908
1,3-Dimethyluric acid
2 spectra
C7H8N4O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
196.05965
LC-ESI-QTOF; MS2; CE:30 V; [M-H]-
MSBNK-RIKEN-PR100869
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100868
1,3-dinitrobenzene
1 spectrum
C6H4N2O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
168.01711
APCI-ITFT; MS2; CE: 35%; R=30000; [M]-
MSBNK-UFZ-UA003905
1,3-Diphenylguanidine
9 spectra
C13H13N3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
211.11095
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002026
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002027
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002029
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU084551
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU084552
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU084553
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU084554
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU084555
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU084556
1,3-Diphenylurea
12 spectra
C13H12N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
212.09500
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111011306
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111011301
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111011305
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111011307
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111011300
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111011298
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111011302
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111011308
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111011303
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111011299
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111011304
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111011297
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