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Name
Formula / Structure
ExactMass
ID
Stanozolol
3 spectra
C21H32N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
328.25146
LC-ESI-Q; MS; POS; 15 V, 60 V
MSBNK-Waters-WA000533
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA000532
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA000531
Stavudine
6 spectra
C10H12N2O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
224.07971
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA002178
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA002177
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA002176
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002175
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA002174
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA002173
Strychnine
4 spectra
C21H22N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
334.16812
LC-ESI-Q; MS; POS; 15 V, 45 V
MSBNK-Waters-WA000648
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA000647
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA000646
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA000645
Sufentanil
5 spectra
C22H30N2O2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
386.20279
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA000644
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA000643
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA000642
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA000641
LC-ESI-Q; MS; POS; 75 V, 90 V
MSBNK-Waters-WA000640
Sulindac
4 spectra
C20H17FO3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
356.08823
LC-ESI-Q; MS; POS; 15 V, 30 V
MSBNK-Waters-WA002494
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA002493
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002492
LC-ESI-Q; MS; POS; 75 V, 90 V
MSBNK-Waters-WA002491
Sulpiride
5 spectra
C15H23N3O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
341.14093
LC-ESI-Q; MS; POS; 15 V, 30 V
MSBNK-Waters-WA002023
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA002022
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002021
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA002020
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA002019
Sultopride
5 spectra
C17H26N2O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
354.16132
LC-ESI-Q; MS; POS; 15 V, 30 V
MSBNK-Waters-WA002172
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA002171
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002170
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA002169
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA002168
Telmisartan
5 spectra
C33H30N4O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
514.23688
LC-ESI-Q; MS; NEG; 30 V
MSBNK-Waters-WA002331
LC-ESI-Q; MS; POS; 15 V, 45 V
MSBNK-Waters-WA002330
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002329
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA002328
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA002327
Temazepam
6 spectra
C16H13ClN2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
300.06656
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA000300
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA000299
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA000298
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA000297
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA000296
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA000295
Teniposide
7 spectra
C32H32O13S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
656.15637
LC-ESI-Q; MS; NEG; 30 V
MSBNK-Waters-WA002627
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA002626
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA002625
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA002624
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002623
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA002622
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA002621
Terbutaline
5 spectra
C12H19NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
225.13649
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA002666
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA002665
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA002664
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002663
LC-ESI-Q; MS; POS; 75 V, 90 V
MSBNK-Waters-WA002662
Terfenadine
6 spectra
C32H41NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
471.31372
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA000471
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA000470
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA000469
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA000468
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA000467
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA000466
Tetracaine
6 spectra
C15H24N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
264.18378
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA002500
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA002499
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA002498
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002497
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA002496
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA002495
Tetrazepam
4 spectra
C16H17ClN2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
288.10294
LC-ESI-Q; MS; POS; 15 V, 30 V
MSBNK-Waters-WA000304
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA000303
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA000302
LC-ESI-Q; MS; POS; 75 V, 90 V
MSBNK-Waters-WA000301
Theophylline
12 spectra
C7H8N4O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
180.06473
LC-ESI-Q; MS; NEG; 30 V
MSBNK-Waters-WA001345
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA000309
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA001344
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA000308
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA001343
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA000307
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA001342
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA000306
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA001341
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA000305
LC-ESI-Q; MS; POS; 75 V, 90 V
MSBNK-Waters-WA001340
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA000310
Thiabendazole
4 spectra
C10H7N3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
201.03607
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Waters-WA000086
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Waters-WA000087
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Waters-WA000088
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Waters-WA000089
Thiacloprid
5 spectra
C10H9ClN4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
252.02364
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Waters-WA000081
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Waters-WA000082
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Waters-WA000083
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Waters-WA000084
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Waters-WA000085
Thiamethoxam
4 spectra
C8H10ClN5O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
291.01929
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Waters-WA000090
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Waters-WA000091
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Waters-WA000092
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Waters-WA000093
Thidiazuron
4 spectra
C9H8N4OS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
220.04189
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Waters-WA000216
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Waters-WA000217
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Waters-WA000218
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Waters-WA000219
Thifensulfuron-methyl
5 spectra
C12H13N5O6S2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
387.03073
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Waters-WA000220
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Waters-WA000221
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Waters-WA000222
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Waters-WA000223
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Waters-WA000224
Thioguanine
5 spectra
C5H5N5S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
167.02657
LC-ESI-Q; MS; NEG; 30 V
MSBNK-Waters-WA002776
LC-ESI-Q; MS; POS; 15 V, 30 V
MSBNK-Waters-WA002775
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA002774
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002773
LC-ESI-Q; MS; POS; 75 V, 90 V
MSBNK-Waters-WA002772
Thiopental
4 spectra
C11H18N2O2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
242.10890
LC-ESI-Q; MS; NEG; 15 V, 30 V
MSBNK-Waters-WA000591
LC-ESI-Q; MS; NEG; 45 V
MSBNK-Waters-WA000590
LC-ESI-Q; MS; NEG; 60 V
MSBNK-Waters-WA000589
LC-ESI-Q; MS; NEG; 75 V, 90 V
MSBNK-Waters-WA000588
Thioproperazine (oxide)
5 spectra
C22H30N4O2S2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
446.18103
LC-ESI-Q; MS; POS; 15 V, 30 V
MSBNK-Waters-WA002167
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA002166
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002165
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA002164
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA002163
Thioridazine (oxide)
5 spectra
C21H26N2S2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
370.15375
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA000639
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA000638
LC-ESI-Q; MS; POS; 45 V, 60 V
MSBNK-Waters-WA000637
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA000636
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA000635
Tianeptine
7 spectra
C21H25ClN2O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
436.12234
LC-ESI-Q; MS; NEG; 30 V
MSBNK-Waters-WA000317
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA000316
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA000315
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA000314
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA000313
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA000312
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA000311
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