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Name
Formula / Structure
ExactMass
ID
PGE2-[3,3,4,4-d4]
1 spectrum
C20H32O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
352.22498
LC-ESI-QQ; MS2
MSBNK-MSSJ-MSJ00054
PGF2alpha
1 spectrum
C20H34O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
354.24063
LC-ESI-QQ; MS2; [M-H]-; Negative
MSBNK-MSSJ-MSJ00046
Phenmedipham
7 spectra
C16H16N2O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
300.11102
LC-ESI-QTOF; MS2; ESI; POSITIVE; [M+H]+; CE 10 V
MSBNK-MSSJ-MSJ02225
LC-ESI-QTOF; MS2; ESI; POSITIVE; [M+H]+; CE 20 V
MSBNK-MSSJ-MSJ02226
LC-ESI-QTOF; MS2; ESI; POSITIVE; [M+H]+; CE 30 V
MSBNK-MSSJ-MSJ02227
LC-ESI-QTOF; MS2; ESI; POSITIVE; [M+H]+; CE 40 V
MSBNK-MSSJ-MSJ02228
LC-ESI-QTOF; MS2; ESI; POSITIVE; [M+H]+; CE 50 V
MSBNK-MSSJ-MSJ02229
LC-ESI-QTOF; MS2; ESI; POSITIVE; [M+H]+; CE 60 V
MSBNK-MSSJ-MSJ02230
LC-ESI-QTOF; MS; ESI; POSITIVE
MSBNK-MSSJ-MSJ02224
Phenylsulfate
7 spectra
C6H6O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
173.99867
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 10 V
MSBNK-MSSJ-MSJ00842
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 20 V
MSBNK-MSSJ-MSJ00843
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 30 V
MSBNK-MSSJ-MSJ00844
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 40 V
MSBNK-MSSJ-MSJ00845
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 50 V
MSBNK-MSSJ-MSJ00846
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 60 V
MSBNK-MSSJ-MSJ00847
ESI-QTOF; MS; NEGATIVE
MSBNK-MSSJ-MSJ00841
Phosphatidyl-6-acetyl-glucose(18:0/20:0)
2 spectra
C49H93O14P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
936.63031
ESI-ITFT; MS2; [M-H]-
MSBNK-MSSJ-MSJ00012
ESI-ITFT; MS; Negative
MSBNK-MSSJ-MSJ00011
Pirimicarb
7 spectra
C11H18N4O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
238.14297
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 10V
MSBNK-MSSJ-MSJ02787
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 20V
MSBNK-MSSJ-MSJ02788
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 30V
MSBNK-MSSJ-MSJ02789
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 40V
MSBNK-MSSJ-MSJ02790
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 50V
MSBNK-MSSJ-MSJ02791
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 60V
MSBNK-MSSJ-MSJ02792
LC-ESI-QTOF; MS; POSITIVE
MSBNK-MSSJ-MSJ02786
Polyporenic acid C
14 spectra
C31H46O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
482.33960
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 10 V
MSBNK-MSSJ-MSJ00370
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 20 V
MSBNK-MSSJ-MSJ00371
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 30 V
MSBNK-MSSJ-MSJ00372
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 40 V
MSBNK-MSSJ-MSJ00373
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 50 V
MSBNK-MSSJ-MSJ00374
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 60 V
MSBNK-MSSJ-MSJ00375
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 10 V
MSBNK-MSSJ-MSJ00363
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 20 V
MSBNK-MSSJ-MSJ00364
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 30 V
MSBNK-MSSJ-MSJ00365
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 40 V
MSBNK-MSSJ-MSJ00366
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 50 V
MSBNK-MSSJ-MSJ00367
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 60 V
MSBNK-MSSJ-MSJ00368
ESI-QTOF; MS; NEGATIVE
MSBNK-MSSJ-MSJ00369
ESI-QTOF; MS; POSITIVE
MSBNK-MSSJ-MSJ00362
Poricoic acid A
13 spectra
C31H46O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
498.33453
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 10 V
MSBNK-MSSJ-MSJ00330
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 20 V
MSBNK-MSSJ-MSJ00331
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 30 V
MSBNK-MSSJ-MSJ00332
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 40 V
MSBNK-MSSJ-MSJ00333
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 50 V
MSBNK-MSSJ-MSJ00334
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 60V
MSBNK-MSSJ-MSJ00335
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 10 V
MSBNK-MSSJ-MSJ00324
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 20 V
MSBNK-MSSJ-MSJ00325
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 30 V
MSBNK-MSSJ-MSJ00326
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 40 V
MSBNK-MSSJ-MSJ00327
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 60 V
MSBNK-MSSJ-MSJ00328
ESI-QTOF; MS; NEGATIVE
MSBNK-MSSJ-MSJ00329
ESI-QTOF; MS; POSITIVE
MSBNK-MSSJ-MSJ00323
Poricoic acid B
14 spectra
C30H44O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
484.31888
ESI-QTOF; MS2; NEGATIVE; [M+H]+; CID; 50 V
MSBNK-MSSJ-MSJ00388
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 10 V
MSBNK-MSSJ-MSJ00384
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 20 V
MSBNK-MSSJ-MSJ00385
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 30 V
MSBNK-MSSJ-MSJ00386
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 40 V
MSBNK-MSSJ-MSJ00387
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 60 V
MSBNK-MSSJ-MSJ00389
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 10 V
MSBNK-MSSJ-MSJ00377
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 20 V
MSBNK-MSSJ-MSJ00378
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 30 V
MSBNK-MSSJ-MSJ00379
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 40 V
MSBNK-MSSJ-MSJ00380
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 50 V
MSBNK-MSSJ-MSJ00381
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 60 V
MSBNK-MSSJ-MSJ00382
ESI-QTOF; MS; NEGATIVE
MSBNK-MSSJ-MSJ00383
ESI-QTOF; MS; POSITIVE
MSBNK-MSSJ-MSJ00376
Pretilachlor
8 spectra
C17H26ClNO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
311.16519
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 10 V
MSBNK-MSSJ-MSJ00265
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 20 V
MSBNK-MSSJ-MSJ00266
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 30 V
MSBNK-MSSJ-MSJ00267
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 40 V
MSBNK-MSSJ-MSJ00268
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 60 V
MSBNK-MSSJ-MSJ00269
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 80 V
MSBNK-MSSJ-MSJ00270
ESI-QTOF; MS2; POSITIVE; [M+H]+; Isotopomer, CID; 30 V
MSBNK-MSSJ-MSJ00271
ESI-QTOF; MS; POSITIVE
MSBNK-MSSJ-MSJ00264
Primisulfuron-methyl
14 spectra
C15H12F4N4O7S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
468.03629
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 10V
MSBNK-MSSJ-MSJ02686
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 20V
MSBNK-MSSJ-MSJ02687
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 30V
MSBNK-MSSJ-MSJ02688
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 40V
MSBNK-MSSJ-MSJ02689
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 50V
MSBNK-MSSJ-MSJ02690
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 60V
MSBNK-MSSJ-MSJ02691
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 10V
MSBNK-MSSJ-MSJ02693
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 20V
MSBNK-MSSJ-MSJ02694
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 30V
MSBNK-MSSJ-MSJ02695
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 40V
MSBNK-MSSJ-MSJ02696
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 50V
MSBNK-MSSJ-MSJ02697
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 60V
MSBNK-MSSJ-MSJ02698
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-MSSJ-MSJ02692
LC-ESI-QTOF; MS; POSITIVE
MSBNK-MSSJ-MSJ02685
Propoxycarbazone
14 spectra
C15H18N4O7S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
398.08963
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 10V
MSBNK-MSSJ-MSJ02542
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 20V
MSBNK-MSSJ-MSJ02543
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 30V
MSBNK-MSSJ-MSJ02544
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 40V
MSBNK-MSSJ-MSJ02545
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 50V
MSBNK-MSSJ-MSJ02546
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 60V
MSBNK-MSSJ-MSJ02547
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 10V
MSBNK-MSSJ-MSJ02549
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 20V
MSBNK-MSSJ-MSJ02550
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 30V
MSBNK-MSSJ-MSJ02551
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 40V
MSBNK-MSSJ-MSJ02552
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 50V
MSBNK-MSSJ-MSJ02553
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 60V
MSBNK-MSSJ-MSJ02554
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-MSSJ-MSJ02548
LC-ESI-QTOF; MS; POSITIVE
MSBNK-MSSJ-MSJ02541
Propyphenazone
6 spectra
C14H18N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
230.14191
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 10 V; [M+H]+
MSBNK-MSSJ-MSJ01868
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 20 V; [M+H]+
MSBNK-MSSJ-MSJ01869
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 30 V; [M+H]+
MSBNK-MSSJ-MSJ01870
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 40 V; [M+H]+
MSBNK-MSSJ-MSJ01871
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 50 V; [M+H]+
MSBNK-MSSJ-MSJ01872
LC-ESI-QQ; MS; ESI; POSITIVE
MSBNK-MSSJ-MSJ01867
Prosulfuron
14 spectra
C15H16F3N5O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
419.08752
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 10V
MSBNK-MSSJ-MSJ02630
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 20V
MSBNK-MSSJ-MSJ02631
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 30V
MSBNK-MSSJ-MSJ02632
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 40V
MSBNK-MSSJ-MSJ02633
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 50V
MSBNK-MSSJ-MSJ02634
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 60V
MSBNK-MSSJ-MSJ02635
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 10V
MSBNK-MSSJ-MSJ02637
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 20V
MSBNK-MSSJ-MSJ02638
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 30V
MSBNK-MSSJ-MSJ02639
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 40V
MSBNK-MSSJ-MSJ02640
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 50V
MSBNK-MSSJ-MSJ02641
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 60V
MSBNK-MSSJ-MSJ02642
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-MSSJ-MSJ02636
LC-ESI-QTOF; MS; POSITIVE
MSBNK-MSSJ-MSJ02629
Pyraclonil
8 spectra
C15H15ClN6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
314.10461
ESI-QTOF; MS2; POSITIVE; [M+H]+; 37Cl-isotopolog ion; CID; 30 V
MSBNK-MSSJ-MSJ00207
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 10 V
MSBNK-MSSJ-MSJ00201
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 20 V
MSBNK-MSSJ-MSJ00202
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 30 V
MSBNK-MSSJ-MSJ00203
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 40 V
MSBNK-MSSJ-MSJ00204
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 60 V
MSBNK-MSSJ-MSJ00205
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 80 V
MSBNK-MSSJ-MSJ00206
ESI-QTOF; MS; POSITIVE
MSBNK-MSSJ-MSJ00200
Pyrazosulfuron-ethyl
14 spectra
C14H18N6O7S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
414.09576
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 10V
MSBNK-MSSJ-MSJ02584
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 20V
MSBNK-MSSJ-MSJ02585
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 30V
MSBNK-MSSJ-MSJ02586
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 40V
MSBNK-MSSJ-MSJ02587
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 50V
MSBNK-MSSJ-MSJ02588
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 60V
MSBNK-MSSJ-MSJ02589
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 10V
MSBNK-MSSJ-MSJ02591
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 20V
MSBNK-MSSJ-MSJ02592
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 30V
MSBNK-MSSJ-MSJ02593
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 40V
MSBNK-MSSJ-MSJ02594
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 50V
MSBNK-MSSJ-MSJ02595
LC-ESI-QTOF; MS2; [M-H]-; CID; CE 60V
MSBNK-MSSJ-MSJ02596
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-MSSJ-MSJ02590
LC-ESI-QTOF; MS; POSITIVE
MSBNK-MSSJ-MSJ02583
Pyriftalid
7 spectra
C15H14N2O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
318.06741
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 10V
MSBNK-MSSJ-MSJ02866
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 20V
MSBNK-MSSJ-MSJ02867
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 30V
MSBNK-MSSJ-MSJ02868
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 40V
MSBNK-MSSJ-MSJ02869
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 50V
MSBNK-MSSJ-MSJ02870
LC-ESI-QTOF; MS2; [M+H]+; CID; CE 60V
MSBNK-MSSJ-MSJ02871
LC-ESI-QTOF; MS; POSITIVE
MSBNK-MSSJ-MSJ02865
Pyrrhoxanthinol
1 spectrum
C37H46O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
570.33453
LC-ESI-QTOF; MS2; POSITIVE; ESI; [M+H]+; COLLISION_ENERGY 20 V
MSBNK-MSSJ-MSJ00149
Quazepam
12 spectra
C17H11ClF4N2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
386.02676
LC-ESI-QQ; MS2; ESI; NEGATIVE; CE 10 V; [M-H]-
MSBNK-MSSJ-MSJ01559
LC-ESI-QQ; MS2; ESI; NEGATIVE; CE 20 V; [M-H]-
MSBNK-MSSJ-MSJ01560
LC-ESI-QQ; MS2; ESI; NEGATIVE; CE 30 V; [M-H]-
MSBNK-MSSJ-MSJ01561
LC-ESI-QQ; MS2; ESI; NEGATIVE; CE 40 V; [M-H]-
MSBNK-MSSJ-MSJ01562
LC-ESI-QQ; MS2; ESI; NEGATIVE; CE 50 V; [M-H]-
MSBNK-MSSJ-MSJ01563
LC-ESI-QQ; MS2; ESI; POSITIVE; CE 10 V; [M+H]+
MSBNK-MSSJ-MSJ01553
LC-ESI-QQ; MS2; ESI; POSITIVE; CE 20 V; [M+H]+
MSBNK-MSSJ-MSJ01554
LC-ESI-QQ; MS2; ESI; POSITIVE; CE 30 V; [M+H]+
MSBNK-MSSJ-MSJ01555
LC-ESI-QQ; MS2; ESI; POSITIVE; CE 40 V; [M+H]+
MSBNK-MSSJ-MSJ01556
LC-ESI-QQ; MS2; ESI; POSITIVE; CE 50 V; [M+H]+
MSBNK-MSSJ-MSJ01557
LC-ESI-QQ; MS; ESI; NEGATIVE
MSBNK-MSSJ-MSJ01558
LC-ESI-QQ; MS; ESI; POSITIVE
MSBNK-MSSJ-MSJ01552
Quercetin 3-O-glucuronide
3 spectra
C21H18O13
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
478.07474
LC-ESI-ITTOF; MS
MSBNK-MSSJ-MSJ00036
LC-ESI-ITTOF; MS2
MSBNK-MSSJ-MSJ00037
LC-ESI-ITTOF; MS3
MSBNK-MSSJ-MSJ00038
Quetiapine
12 spectra
C21H25N3O2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
383.16675
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 10 V; [M-H]-
MSBNK-MSSJ-MSJ01976
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 20 V; [M-H]-
MSBNK-MSSJ-MSJ01977
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 30 V; [M-H]-
MSBNK-MSSJ-MSJ01978
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 40 V; [M-H]-
MSBNK-MSSJ-MSJ01979
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 50 V; [M-H]-
MSBNK-MSSJ-MSJ01980
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 10 V; [M+H]+
MSBNK-MSSJ-MSJ01970
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 20 V; [M+H]+
MSBNK-MSSJ-MSJ01971
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 30 V; [M+H]+
MSBNK-MSSJ-MSJ01972
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 40 V; [M+H]+
MSBNK-MSSJ-MSJ01973
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 50 V; [M+H]+
MSBNK-MSSJ-MSJ01974
LC-ESI-QQ; MS; ESI; NEGATIVE
MSBNK-MSSJ-MSJ01975
LC-ESI-QQ; MS; ESI; POSITIVE
MSBNK-MSSJ-MSJ01969
Quinoclamine
15 spectra
C10H6ClNO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
207.00870
ESI-QTOF; MS2; NEGATIVE; [M-H]-; 37Cl-isotopolog ion; CID; 20 V
MSBNK-MSSJ-MSJ00263
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 10 V
MSBNK-MSSJ-MSJ00257
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 20 V
MSBNK-MSSJ-MSJ00258
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 30 V
MSBNK-MSSJ-MSJ00259
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 40 V
MSBNK-MSSJ-MSJ00260
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 60 V
MSBNK-MSSJ-MSJ00261
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 80 V
MSBNK-MSSJ-MSJ00262
ESI-QTOF; MS2; POSITIVE; [M+H]+; 37Cl-isotopolog ion; CID; 30 V
MSBNK-MSSJ-MSJ00255
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 10 V
MSBNK-MSSJ-MSJ00249
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 20 V
MSBNK-MSSJ-MSJ00250
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 30 V
MSBNK-MSSJ-MSJ00251
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 40 V
MSBNK-MSSJ-MSJ00252
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 60 V
MSBNK-MSSJ-MSJ00253
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 80 V
MSBNK-MSSJ-MSJ00254
ESI-QTOF; MS; NEGATIVE
MSBNK-MSSJ-MSJ00256
rac-(2R,3S,5R)-5-(But-3-en-1-yl)-3-acetoxy-2-(acet...
2 spectra
C13H20O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
256.13107
GC-EI-TOF; MS; POSITIVE; EI; 70 V
MSBNK-MSSJ-MSJ02080
GC-FI-TOF; MS; POSITIVE; FI; 10 kV
MSBNK-MSSJ-MSJ02081
rac-(2R,5R)-2-((S)-2-acetoxybut-3-en-1-yl)-5-(acet...
2 spectra
C13H20O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
256.13107
GC-EI-TOF; MS; POSITIVE; EI; 70 V
MSBNK-MSSJ-MSJ02082
GC-FI-TOF; MS; POSITIVE; FI; 10 kV
MSBNK-MSSJ-MSJ02083
rac-(2S,3S,5S)-5-(But-3-en-1-yl)-3-acetoxy-2-(acet...
2 spectra
C13H20O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
256.13107
GC-EI-TOF; MS; POSITIVE; EI; 70 V
MSBNK-MSSJ-MSJ02084
GC-FI-TOF; MS; POSITIVE; FI; 10 kV
MSBNK-MSSJ-MSJ02085
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