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Results End
Name
Formula / Structure
ExactMass
ID
Atraton
6 spectra
C9H17N5O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
211.14330
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU046401
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU046402
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU046403
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU046404
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU046405
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU046406
Atrazine
6 spectra
C8H14ClN5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
215.09380
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU071801
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU071802
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU071803
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU071804
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU071805
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU071806
AVE2865
12 spectra
C20H17ClF3N3O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
455.08600
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU063201
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU063251
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU063202
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU063252
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU063203
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU063253
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU063204
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU063254
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU063205
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU063255
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU063206
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU063256
AVE3247
12 spectra
C25H24ClN5O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
525.12378
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU060101
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU060151
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU060102
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU060152
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU060103
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU060153
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU060104
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU060154
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU060105
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU060155
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU060106
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU060156
AVE3295
12 spectra
C25H22FN3O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
463.13660
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU100301
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU100351
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU100302
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU100352
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU100303
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU100353
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU100304
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU100354
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU100305
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU100355
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU100306
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU100356
AVE5638
6 spectra
C25H23FN2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
402.17441
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU047901
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU047902
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU047903
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU047904
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU047905
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU047906
AVE6324
12 spectra
C31H35ClN4O7S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
642.19153
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU121901
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU121951
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU121902
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU121952
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU121903
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU121953
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU121904
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU121954
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU121905
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU121955
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU121906
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU121956
AVE9423
12 spectra
C23H12Cl2F2N2O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
504.00909
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU048001
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU048051
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU048002
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU048052
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU048003
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU048053
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU048004
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU048054
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU048005
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU048055
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU048006
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU048056
Azaconazole
6 spectra
C12H11Cl2N3O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
299.02280
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU056601
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU056602
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU056603
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU056604
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU056605
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU056606
Azacyclotridecan-2-one
6 spectra
C12H23NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
197.17799
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU080701
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU080702
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU080703
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU080704
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU080705
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU080706
Azathioprine
12 spectra
C9H7N7O2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
277.03821
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU126201
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU126251
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU126202
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU126252
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU126203
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU126253
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU126204
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU126254
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU126205
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU126255
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU126206
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU126256
Aziprotryne
12 spectra
C7H11N7S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
225.07970
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU084901
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU084951
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU084902
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU084952
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU084903
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU084953
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU084904
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU084954
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU084905
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU084955
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU084906
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU084956
Azoxystrobin
6 spectra
C22H17N3O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
403.11679
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU120801
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU120802
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU120803
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU120804
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU120805
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU120806
Benalaxyl
6 spectra
C20H23NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
325.16779
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU056701
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU056702
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU056703
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU056704
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU056705
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU056706
Benodanil
6 spectra
C13H10INO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
322.98071
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU020301
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU020302
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU020303
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU020304
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU020305
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU020306
Bensulide
12 spectra
C14H24NO4PS3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
397.06049
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU137901
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU137951
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU137902
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU137952
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU137903
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU137953
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU137904
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU137954
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU137905
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU137955
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU137906
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU137956
Bentazone
6 spectra
C10H12N2O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
240.05690
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU120451
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU120452
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU120453
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU120454
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU120455
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU120456
Benzadox
10 spectra
C9H9NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
195.05321
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU038201
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU038251
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU038252
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU038253
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU038204
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU038254
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU038205
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU038255
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU038206
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU038256
Benzenesulfonic acid
6 spectra
C6H6O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
158.00380
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU136951
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU136952
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU136953
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU136954
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU136955
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU136956
Benzyl butyl phthalate
6 spectra
C19H20O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
312.13620
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU083701
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU083702
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU083703
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU083704
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU083705
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU083706
Benzylparaben
6 spectra
C14H12O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
228.07860
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU078051
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU078052
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU078053
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU078054
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU078055
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU078056
Besonprodil
12 spectra
C21H23FN2O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
402.14130
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU026401
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU026451
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU026402
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU026452
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU026403
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU026453
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU026404
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU026454
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU026405
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU026455
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU026406
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU026456
Betamethasone
6 spectra
C22H29FO5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
392.19989
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU055201
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU055202
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU055203
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU055204
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU055205
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU055206
Betamethasone valerate
6 spectra
C27H37FO6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
476.25739
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU066701
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU066702
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU066703
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU066704
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU066705
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU066706
Bexarotene
4 spectra
C24H28O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
348.20889
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU050151
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU050152
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU050153
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU050154
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