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Name
Formula / Structure
ExactMass
ID
Stepharine
5 spectra
C18H19NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
297.35699
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01167
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01166
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01165
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01168
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000089
Sterigmatocystin
25 spectra
C18H12O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
324.06339
LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002521
LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003662
LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003663
LC-ESI-ITFT; MS2; CE: 10; R=17500; [M+H]+
MSBNK-AAFC-AC000224
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002522
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002523
LC-ESI-ITFT; MS2; CE: 20; R=17500; [M+H]+
MSBNK-AAFC-AC000225
LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002524
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002525
LC-ESI-ITFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-AAFC-AC000226
LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002914
LC-ESI-ITFT; MS2; CE: 35; R=17500; [M+H]+
MSBNK-AAFC-AC000227
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002915
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002916
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002917
LC-ESI-ITFT; MS2; CE: 50; R=17500; [M+H]+
MSBNK-AAFC-AC000228
LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002918
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003289
LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003290
LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003291
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003292
LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003293
LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003659
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003660
LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003661
Steviobioside
5 spectra
C32H50O13
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
642.74750
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02450
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02451
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02452
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02449
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000416
Stictic acid
1 spectrum
C19H14O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
386.31799
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000336
STIGMAST-5-EN-3BETA-OL
2 spectra
C29H50O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
414.38617
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002090
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002699
STIGMAST-5-ENE-3BETA-OL
1 spectrum
C29H50O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
414.38617
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP000028
STIGMASTA-5,24(28)-DIEN-3-OL ACETATE
1 spectrum
C31H50O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
454.38107
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002710
Stigmastanol
7 spectra
C29H52O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
416.40182
LC-APPI-QQ; MS
MSBNK-PFOS_research_group-FFF00083
LC-APPI-QQ; MS2; CE:10 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00082
LC-APPI-QQ; MS2; CE:20 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00081
LC-APPI-QQ; MS2; CE:30 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00080
LC-APPI-QQ; MS2; CE:40 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00079
LC-APPI-QQ; MS2; CE:50 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00078
LC-APPI-QQ; MS2; CE:60 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00077
STIGMASTEROL
4 spectra
C29H48O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
412.37051
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002749
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002860
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004124
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008291
Stigmasterol
7 spectra
C29H48O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
412.37051
LC-APPI-QQ; MS
MSBNK-PFOS_research_group-FFF00271
LC-APPI-QQ; MS2; CE:10 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00270
LC-APPI-QQ; MS2; CE:20 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00269
LC-APPI-QQ; MS2; CE:30 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00268
LC-APPI-QQ; MS2; CE:40 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00267
LC-APPI-QQ; MS2; CE:50 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00266
LC-APPI-QQ; MS2; CE:60 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00265
STIGMASTEROL ACETATE
2 spectra
C31H50O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
454.38107
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002707
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP011654
STIGMASTEROL TMS ETHER
1 spectrum
C32H56OSi
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
484.41003
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP005754
STIGMASTERONE
2 spectra
C29H46O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
410.35486
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002859
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008290
STIGMASTERYL TRIMETHYLSILYL ETHER
1 spectrum
C32H56OSi
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
484.41003
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP006232
Stipitatic acid
4 spectra
C8H6O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
182.02151
LC-ESI-ITFT; MS2; CE: 10; R=17500; [M+H]+
MSBNK-AAFC-AC000229
LC-ESI-ITFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-AAFC-AC000230
LC-ESI-ITFT; MS2; CE: 35; R=17500; [M+H]+
MSBNK-AAFC-AC000231
LC-ESI-ITFT; MS2; CE: 40; R=17500; [M+H]+
MSBNK-AAFC-AC000232
Streptomycin
15 spectra
C21H39N7O12
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
581.26569
LC-ESI-QQ; MS2; CE:10 V; [M+2H]++
MSBNK-Keio_Univ-KO004002
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003997
LC-ESI-QQ; MS2; CE:20 V; [M+2H]++
MSBNK-Keio_Univ-KO004003
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003998
LC-ESI-QQ; MS2; CE:30 V; [M+2H]++
MSBNK-Keio_Univ-KO004004
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003999
LC-ESI-QQ; MS2; CE:40 V; [M+2H]++
MSBNK-Keio_Univ-KO004005
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO004000
LC-ESI-QQ; MS2; CE:50 V; [M+2H]++
MSBNK-Keio_Univ-KO004006
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO004001
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000406
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000407
LC-ESI-QTOF; MS2; CE:30 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000408
LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000409
LC-ESI-QTOF; MS2; CE:50 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000410
Strictosamide
1 spectrum
C26H30N2O8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
498.53201
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR311107
Strictosidine
3 spectra
C27H34N2O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
530.22644
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML82477
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR311110
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML82475
Strictosidinic acid
1 spectrum
C26H32N2O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
516.54700
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR311109
Strophanthidinic acid
5 spectra
C23H32O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
420.50729
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03166
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03167
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03168
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03165
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000355
STRYCHNINE
1 spectrum
C21H22N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
334.16812
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP003086
Strychnine
38 spectra
C21H22N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
334.16812
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML82222
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
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU069401
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU069402
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU069403
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU069404
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU069405
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU069406
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01159
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01158
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01157
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01160
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000068
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300490
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300495
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300500
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300505
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300510
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300515
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300519
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300524
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300529
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300534
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300539
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300543
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310586
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00638
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00649
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00660
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000411
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000412
LC-ESI-QTOF; MS2; CE:30 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000413
LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000414
LC-ESI-QTOF; MS2; CE:50 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000415
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML82220
Strychnine_N_Oxide
5 spectra
C21H22N2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
350.16302
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000416
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000417
LC-ESI-QTOF; MS2; CE:30 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000418
LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000419
LC-ESI-QTOF; MS2; CE:50 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000420
Styrene
3 spectra
C8H8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
104.06260
GC-APCI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU501102
GC-APCI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU501103
GC-APCI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU501104
STYRENE
1 spectrum
C8H8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
104.06260
CI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP012244
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