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5,547 Hit.
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Name
Formula / Structure
ExactMass
ID
Saikosaponin b2
37 spectra
C42H68O13
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
780.99298
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303842
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303846
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303850
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303854
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303858
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303862
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303866
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303870
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303874
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303878
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303882
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303886
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307746
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307747
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307751
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307752
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307756
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307757
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307761
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307762
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307766
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307767
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307771
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307775
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307776
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307780
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307781
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307785
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307786
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307790
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307791
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307795
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307796
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307800
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307801
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308693
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308696
Saikosaponin C
32 spectra
C48H78O17
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
926.52393
LC-ESI-ITTOF; MS2; [M-H]-
MSBNK-Univ_Toyama-TY000113
LC-ESI-ITTOF; MS; [M+CH3COOH-H]-
MSBNK-Univ_Toyama-TY000195
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304348
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304352
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304356
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304360
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304364
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304371
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304378
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304382
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304386
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304390
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308433
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308434
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308439
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308440
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308444
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308449
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308453
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308454
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308458
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308462
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308465
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308469
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308470
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308475
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308479
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308483
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308484
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308698
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308701
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310403
Saikosaponin D
36 spectra
C42H68O13
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
780.46600
LC-ESI-ITTOF; MS2; [M-H]-
MSBNK-Univ_Toyama-TY000114
LC-ESI-ITTOF; MS; [M-H]-
MSBNK-Univ_Toyama-TY000196
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304350
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304354
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304358
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304362
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304366
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304369
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304373
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304376
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304380
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304384
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304388
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR304392
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308437
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308438
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308442
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308443
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308447
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308448
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308452
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308456
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308457
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308461
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308463
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308464
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308467
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308468
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308473
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308474
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308478
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308481
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308482
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308486
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308487
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310401
Sakuranetin
42 spectra
C16H14O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
286.08411
GC-EI-TOF; MS; n TMS; RT:1058.834 sec
MSBNK-Osaka_Univ-OUF00449
GC-EI-TOF; MS; n TMS; RT:1080.632 sec
MSBNK-Osaka_Univ-OUF00450
LC-ESI-ITTOF; MS; [M+H]+
MSBNK-Univ_Toyama-TY000141
LC-ESI-ITTOF; MS; [M-H]-
MSBNK-Univ_Toyama-TY000142
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086601
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086602
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086603
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086604
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086605
LC-ESI-QTOF; MS
MSBNK-BS-BS003564
LC-ESI-QTOF; MS
MSBNK-RIKEN-PR020021
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302346
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302352
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302358
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302364
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302369
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302375
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302380
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302385
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302390
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302395
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302401
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302406
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306012
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306018
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306024
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306030
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306036
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306042
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306048
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306053
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306059
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306065
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306071
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306076
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR309313
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR311001
LC-ESI-QTOF; MS2; CE:10 eV; [M-H]-
MSBNK-BS-BS003561
LC-ESI-QTOF; MS2; CE:20 eV; [M-H]-
MSBNK-BS-BS003562
LC-ESI-QTOF; MS2; CE:30 eV; [M-H]-
MSBNK-BS-BS003560
LC-ESI-QTOF; MS2; CE:40 eV; [M-H]-
MSBNK-BS-BS003563
LC-ESI-QTOF; MS; CE:10 eV; [M-H]-
MSBNK-BS-BS003565
Salazinic acid
1 spectrum
C18H12O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
388.29031
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000270
Salbutamol
36 spectra
C13H21NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
239.15210
LC-APCI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M+H]+
MSBNK-ACES_SU-AS000135
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA000685
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA000684
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA000683
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA000682
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA000681
LC-ESI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M+H]+
MSBNK-ACES_SU-AS000202
LC-ESI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M-H]-
MSBNK-ACES_SU-AS000262
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311092446
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311106765
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL2311092449
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL2311106778
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL2311106771
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL2311106776
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL2311106773
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL2311106770
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL2311106777
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311092453
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311106767
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311092452
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311106780
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311092448
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311092454
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311106766
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311106769
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311092451
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311106774
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311092447
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311106768
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311092450
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311106775
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL2311092455
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL2311106772
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL2311106779
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU110001
LC-ESI-QTOF; MS2; CE: Ramp 19.4-29.2 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU110002
Salicin
4 spectra
C13H18O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
286.10526
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML82128
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01096
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML82126
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML82125
Salicyl alcohol-beta-glucoside
1 spectrum
C13H18O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
286.10526
GC-EI-TOF; MS; n TMS; RT:943.120 sec
MSBNK-Osaka_Univ-OUF00451
SALICYLALDEHYDE
2 spectra
C7H6O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
122.03678
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004125
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008920
SALICYLALDEHYDE OXIME
1 spectrum
C7H7NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
137.04768
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP010788
Salicylaldehyde oxime
2 spectra
C7H7NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
137.04768
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001040
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001041
SALICYLALDOXIME
1 spectrum
C7H7NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
137.04768
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP009493
SALICYLAMIDE
1 spectrum
C7H7NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
137.04768
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP003536
Salicylamide
24 spectra
C7H7NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
137.04770
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU054651
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU054652
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU054653
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU054654
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU054655
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU054656
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111027425
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111027452
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111027426
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111027453
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111027427
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111027454
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111027428
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111027433
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111027455
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111027460
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111027429
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111027456
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111027430
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111027457
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111027431
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111027458
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111027432
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111027459
Salicylanilide
8 spectra
C13H11NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
213.07899
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU115501
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU115551
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU115552
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU115553
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU115554
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU115505
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU115555
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU115556
Salicylhydroxamic acid
6 spectra
C7H7NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
153.04259
ESI-QTOF; MS2; CE: 10; [M+H]+
MSBNK-EPA-ENTACT_AGILENT001443
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001445
ESI-QTOF; MS2; CE: 20; [M+H]+
MSBNK-EPA-ENTACT_AGILENT001442
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001444
ESI-QTOF; MS2; CE: 40; [M+H]+
MSBNK-EPA-ENTACT_AGILENT001440
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001441
SALICYLIC ACID
1 spectrum
C7H6O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
138.03169
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP011792
Salicylic acid
50 spectra
C7H6O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
138.03169
LC-ESI-Q; MS; NEG; 15 V
MSBNK-Waters-WA000475
LC-ESI-Q; MS; NEG; 30 V
MSBNK-Waters-WA000474
LC-ESI-Q; MS; NEG; 45 V
MSBNK-Waters-WA000473
LC-ESI-Q; MS; NEG; 60 V, 75 V
MSBNK-Waters-WA000472
LC-ESI-QFT; MS2; CE: 120; R=35000; [M+H]+
MSBNK-Eawag-EQ369607
LC-ESI-QFT; MS2; CE: 120; R=35000; [M-H]-
MSBNK-Eawag-EQ369657
LC-ESI-QFT; MS2; CE: 150; R=35000; [M+H]+
MSBNK-Eawag-EQ369608
LC-ESI-QFT; MS2; CE: 150; R=35000; [M-H]-
MSBNK-Eawag-EQ369658
LC-ESI-QFT; MS2; CE: 15; R=35000; [M+H]+
MSBNK-Eawag-EQ369601
LC-ESI-QFT; MS2; CE: 15; R=35000; [M-H]-
MSBNK-Eawag-EQ369651
LC-ESI-QFT; MS2; CE: 180; R=35000; [M+H]+
MSBNK-Eawag-EQ369609
LC-ESI-QFT; MS2; CE: 180; R=35000; [M-H]-
MSBNK-Eawag-EQ369659
LC-ESI-QFT; MS2; CE: 30; R=35000; [M+H]+
MSBNK-Eawag-EQ369602
LC-ESI-QFT; MS2; CE: 30; R=35000; [M-H]-
MSBNK-Eawag-EQ369652
LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+
MSBNK-Eawag-EQ369603
LC-ESI-QFT; MS2; CE: 45; R=35000; [M-H]-
MSBNK-Eawag-EQ369653
LC-ESI-QFT; MS2; CE: 60; R=35000; [M+H]+
MSBNK-Eawag-EQ369604
LC-ESI-QFT; MS2; CE: 60; R=35000; [M-H]-
MSBNK-Eawag-EQ369654
LC-ESI-QFT; MS2; CE: 75; R=35000; [M+H]+
MSBNK-Eawag-EQ369605
LC-ESI-QFT; MS2; CE: 75; R=35000; [M-H]-
MSBNK-Eawag-EQ369655
LC-ESI-QFT; MS2; CE: 90; R=35000; [M+H]+
MSBNK-Eawag-EQ369606
LC-ESI-QFT; MS2; CE: 90; R=35000; [M-H]-
MSBNK-Eawag-EQ369656
LC-ESI-QFT; MS2; NEGATIVE; generated fron DDA dataset
MSBNK-SMB_Measured-HSA002P0137000
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001003
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001004
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001005
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001006
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001007
LC-ESI-QTOF; MS
MSBNK-BS-BS003127
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111011366
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111011372
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111011369
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111011371
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111011368
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111011365
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111011367
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111011370
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111011361
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111011362
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111011373
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111011363
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111011364
LC-ESI-QTOF; MS2; CE: 10; R=; [M+H]+
MSBNK-BGC_Munich-RP017001
LC-ESI-QTOF; MS2; CE: 10; R=; [M-H]-
MSBNK-BGC_Munich-RP017011
LC-ESI-QTOF; MS2; CE: 20; R=; [M+H]+
MSBNK-BGC_Munich-RP017002
LC-ESI-QTOF; MS2; CE: 20; R=; [M-H]-
MSBNK-BGC_Munich-RP017012
LC-ESI-QTOF; MS2; CE: 40; R=; [M+H]+
MSBNK-BGC_Munich-RP017003
LC-ESI-QTOF; MS2; CE: 40; R=; [M-H]-
MSBNK-BGC_Munich-RP017013
LC-ESI-QTOF; MS2; CE: Ramp 17.5-26.2 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU238262
LC-ESI-QTOF; MS2; CE:10 eV; [M-H]-
MSBNK-BS-BS003128
SALICYLIC ALDEHYDE
1 spectrum
C7H6O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
122.03678
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP005646
Salmeterol
11 spectra
C25H37NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
415.27225
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA002484
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA002483
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA002485
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA002482
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002481
LC-ESI-Q; MS; POS; 75 V, 90 V
MSBNK-Waters-WA002480
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000396
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000397
LC-ESI-QTOF; MS2; CE:30 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000398
LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000399
LC-ESI-QTOF; MS2; CE:50 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000400
Salsolidine
2 spectra
C12H17NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
207.12593
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML82132
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML82130
Salsoline
2 spectra
C11H15NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
193.11028
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML82137
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML82135
Salsolinol
7 spectra
C10H13NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
179.09464
LC-ESI-ITFT; MS2; CE 35 eV; [M+H]+
MSBNK-MPI_for_Chemical_Ecology-CE000066
LC-ESI-ITFT; MS2; CE 45 eV; [M+H]+
MSBNK-MPI_for_Chemical_Ecology-CE000067
LC-ESI-ITFT; MS2; CE 55 eV; [M+H]+
MSBNK-MPI_for_Chemical_Ecology-CE000068
LC-ESI-ITFT; MS2; CE 70 eV; [M+H]+
MSBNK-MPI_for_Chemical_Ecology-CE000069
LC-ESI-ITFT; MS; [M+H]+; isotope pattern
MSBNK-MPI_for_Chemical_Ecology-CE000070
LC-ESI-QQ; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB002163
LC-ESI-QQ; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB002164
Saluamine
32 spectra
C7H7ClN2O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
249.98151
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311092098
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311095856
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL2311092092
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL2311095857
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL2311092091
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL2311095858
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL2311092099
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL2311095855
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL2311092093
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL2311095870
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL2311092101
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL2311095860
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL2311092102
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL2311095859
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311092090
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311095867
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311092103
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311095864
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311092089
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311092095
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311095863
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311095868
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311092100
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311095869
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311092097
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311095861
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311092094
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311095866
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL2311092096
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL2311095862
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL2311092088
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL2311095865
Salutaridine
5 spectra
C19H21NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
327.38351
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02339
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02338
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02337
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02340
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000117
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