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Name
Formula / Structure
ExactMass
ID
Bayogenin base + O-Hex
1 spectrum
C36H58O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
650.84998
LC-ESI-QTOF; MS2
PR308900
Bayogenin base + O-Hex, O-Hex-Hex
1 spectrum
C48H78O20
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
975.13202
LC-ESI-QTOF; MS2
PR308930
Bayogenin base + O-Hex-Hex
2 spectra
C42H68O15
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
812.99103
LC-ESI-QTOF; MS2
PR308916
LC-ESI-QTOF; MS2
PR310667
Bayogenin base + O-HexA
1 spectrum
C38H60O11
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
692.88702
LC-ESI-QTOF; MS2
PR308905
Beauvericin
19 spectra
C45H57N3O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
783.40948
LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
NA002571
LC-ESI-ITFT; MS2; CE: 10; R=17500; [M+H]+
AC000574
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
NA002572
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
NA002573
LC-ESI-ITFT; MS2; CE: 20; R=17500; [M+H]+
AC000575
LC-ESI-ITFT; MS2; CE: 20; R=17500; [M+Na]+
AC000579
LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
NA002574
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
NA002575
LC-ESI-ITFT; MS2; CE: 30; R=17500; [M+H]+
AC000576
LC-ESI-ITFT; MS2; CE: 30; R=17500; [M+Na]+
AC000580
LC-ESI-ITFT; MS2; CE: 35; R=17500; [M+H]+
AC000577
LC-ESI-ITFT; MS2; CE: 35; R=17500; [M+Na]+
AC000581
LC-ESI-ITFT; MS2; CE: 50; R=17500; [M+H]+
AC000578
LC-ESI-ITFT; MS2; CE: 50; R=17500; [M+Na]+
AC000582
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00693
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00694
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00695
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00696
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00697
Beclamide
4 spectra
C10H12ClNO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
197.06075
LC-ESI-Q; MS; POS; 15 V
WA001486
LC-ESI-Q; MS; POS; 30 V
WA001485
LC-ESI-Q; MS; POS; 45 V
WA001484
LC-ESI-Q; MS; POS; 60 V, 90 V
WA001483
Beclomethasone dipropionate
6 spectra
C28H37ClO7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
520.22278
LC-ESI-Q; MS; NEG; 30 V
WA002393
LC-ESI-Q; MS; POS; 15 V
WA002392
LC-ESI-Q; MS; POS; 30 V
WA002391
LC-ESI-Q; MS; POS; 45 V
WA002390
LC-ESI-Q; MS; POS; 60 V
WA002389
LC-ESI-Q; MS; POS; 75 V, 90 V
WA002388
Behenic acid
6 spectra
C22H44O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
340.33414
GC-EI-TOF; MS; n TMS; RT:987.066 sec
OUF00124
LC-ESI-QTOF; MS
BS003889
LC-ESI-QTOF; MS2; CE:10 eV; [M-H]-
BS003887
LC-ESI-QTOF; MS2; CE:20 eV; [M-H]-
BS003890
LC-ESI-QTOF; MS2; CE:30 eV; [M-H]-
BS003888
LC-ESI-QTOF; MS2; CE:40 eV; [M-H]-
BS003886
Beheninic Acid, Docosanoate, Carboxylic Acid C22, ...
1 spectrum
C22H44O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
340.59201
LC-ESI-QQ; MS2
PS067801
Bekanamycin
10 spectra
C18H37N5O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
483.25403
LC-ESI-QQ; MS2; CE:10 V; [M+2H]++
KO002488
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
KO002483
LC-ESI-QQ; MS2; CE:20 V; [M+2H]++
KO002489
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
KO002484
LC-ESI-QQ; MS2; CE:30 V; [M+2H]++
KO002490
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
KO002485
LC-ESI-QQ; MS2; CE:40 V; [M+2H]++
KO002491
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
KO002486
LC-ESI-QQ; MS2; CE:50 V; [M+2H]++
KO002492
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
KO002487
Bemetizide
6 spectra
C15H16ClN3O4S2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
401.02707
LC-ESI-Q; MS; NEG; 30 V
WA001815
LC-ESI-Q; MS; POS; 15 V
WA001814
LC-ESI-Q; MS; POS; 30 V
WA001813
LC-ESI-Q; MS; POS; 45 V
WA001812
LC-ESI-Q; MS; POS; 60 V
WA001811
LC-ESI-Q; MS; POS; 75 V, 90 V
WA001810
Benalaxyl
14 spectra
C20H23NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
325.16779
APCI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
UA003203
ESI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
UA003201
LC-ESI-QFT; MS2; CE: 15; R=35000; [M+H]+
EQ303501
LC-ESI-QFT; MS2; CE: 30; R=35000; [M+H]+
EQ303502
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
SM844702
LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+
EQ303503
LC-ESI-QFT; MS2; CE: 60; R=35000; [M+H]+
EQ303504
LC-ESI-QFT; MS2; CE: 75; R=35000; [M+H]+
EQ303505
LC-ESI-QFT; MS2; CE: 90; R=35000; [M+H]+
EQ303506
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
AU262201
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
AU262202
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
AU262203
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
AU262205
LC-ESI-QTOF; MS2; CE: Ramp 22.1-33.2 eV; R=35000; [M+H]+
AU262206
Bendiocarb
11 spectra
C11H13NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
223.08450
LC-ESI-ITFT; MS2; CE: 35; R=15000; [M+H]+
UF402403
LC-ESI-ITFT; MS2; CE: 55; R=15000; [M+H]+
UF402401
LC-ESI-ITFT; MS2; CE: 55; R=15000; [M+H]+
UF402404
LC-ESI-ITFT; MS2; CE: 80; R=15000; [M+H]+
UF402402
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
SM847601
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
AU260601
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
AU260602
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
AU260603
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
AU260604
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
AU260605
LC-ESI-QTOF; MS2; CE: Ramp 18.9-28.3 eV; R=35000; [M+H]+
AU260606
Bendroflumethiazide
5 spectra
C15H14F3N3O4S2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
421.03778
LC-ESI-Q; MS; NEG; 30 V
WA001809
LC-ESI-Q; MS; POS; 15 V
WA001808
LC-ESI-Q; MS; POS; 30 V
WA001807
LC-ESI-Q; MS; POS; 45 V
WA001806
LC-ESI-Q; MS; POS; 60 V, 90 V
WA001805
Benflurorex
6 spectra
C19H20F3NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
351.14462
LC-ESI-Q; MS; POS; 15 V
WA001623
LC-ESI-Q; MS; POS; 30 V
WA001622
LC-ESI-Q; MS; POS; 45 V
WA001621
LC-ESI-Q; MS; POS; 60 V
WA001620
LC-ESI-Q; MS; POS; 75 V
WA001619
LC-ESI-Q; MS; POS; 90 V
WA001618
Benorylate
6 spectra
C17H15NO5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
313.09503
LC-ESI-Q; MS; POS; 15 V
WA001804
LC-ESI-Q; MS; POS; 30 V
WA001803
LC-ESI-Q; MS; POS; 45 V
WA001802
LC-ESI-Q; MS; POS; 60 V
WA001801
LC-ESI-Q; MS; POS; 75 V
WA001800
LC-ESI-Q; MS; POS; 90 V
WA001799
BENOXAPROFENE
1 spectrum
C16H12ClNO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
301.05057
EI-B; MS
JP009516
Benproperine
6 spectra
C21H27NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
309.20926
LC-ESI-QFT; MS2; CE: 15; R=35000; [M+H]+
EQ329601
LC-ESI-QFT; MS2; CE: 30; R=35000; [M+H]+
EQ329602
LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+
EQ329603
LC-ESI-QFT; MS2; CE: 60; R=35000; [M+H]+
EQ329604
LC-ESI-QFT; MS2; CE: 75; R=35000; [M+H]+
EQ329605
LC-ESI-QFT; MS2; CE: 90; R=35000; [M+H]+
EQ329606
Benserazide
14 spectra
C10H15N3O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
257.10117
LC-ESI-Q; MS; POS; 15 V
WA001798
LC-ESI-Q; MS; POS; 30 V
WA001797
LC-ESI-Q; MS; POS; 45 V
WA001796
LC-ESI-Q; MS; POS; 60 V
WA001795
LC-ESI-QFT; MS2; CE: 15; R=35000; [M+H]+
EQ285301
LC-ESI-QFT; MS2; CE: 15; R=35000; [M-H]-
EQ285351
LC-ESI-QFT; MS2; CE: 30; R=35000; [M-H]-
EQ285352
LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+
EQ285303
LC-ESI-QFT; MS2; CE: 45; R=35000; [M-H]-
EQ285353
LC-ESI-QFT; MS2; CE: 60; R=35000; [M+H]+
EQ285304
LC-ESI-QFT; MS2; CE: 60; R=35000; [M-H]-
EQ285354
LC-ESI-QFT; MS2; CE: 75; R=35000; [M-H]-
EQ285355
LC-ESI-QFT; MS2; CE: 90; R=35000; [M+H]+
EQ285306
LC-ESI-QFT; MS2; CE: 90; R=35000; [M-H]-
EQ285356
Bensulfuron-methyl
7 spectra
C16H18N4O7S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
410.08960
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 10 V
MSJ00235
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 20 V
MSJ00236
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 30 V
MSJ00237
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 40 V
MSJ00238
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 60 V
MSJ00239
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 80 V
MSJ00240
ESI-QTOF; MS; NEGATIVE
MSJ00234
BENSULIDE
1 spectrum
C14H24NO4PS3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
397.06052
EI-B; MS
JP010733
Bentazon
7 spectra
C10H12N2O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
240.05685
LC-ESI-IT; MS2; m/z: 241; [M+H]+
KO008894
LC-ESI-IT; MS3; m/z: 241/199; [M+H]+
KO008895
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
KO000371
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
KO000372
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
KO000373
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
KO000374
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
KO000375
Bentazone
42 spectra
C10H12N2O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
240.05630
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
EA025308
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M-H]-
EA025358
LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M+H]+
EA025302
LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M-H]-
EA025352
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
EA025309
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M-H]-
EA025359
LC-ESI-ITFT; MS2; CE: 30%; R=7500; [M+H]+
EA025303
LC-ESI-ITFT; MS2; CE: 30%; R=7500; [M-H]-
EA025353
LC-ESI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
EA025314
LC-ESI-ITFT; MS2; CE: 35%; R=30000; [M-H]-
EA025364
LC-ESI-ITFT; MS2; CE: 35%; R=7500; [M+H]+
EA025301
LC-ESI-ITFT; MS2; CE: 35%; R=7500; [M-H]-
EA025351
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
EA025310
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M-H]-
EA025360
LC-ESI-ITFT; MS2; CE: 45%; R=7500; [M+H]+
EA025304
LC-ESI-ITFT; MS2; CE: 45%; R=7500; [M-H]-
EA025354
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
EA025311
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M-H]-
EA025361
LC-ESI-ITFT; MS2; CE: 60%; R=7500; [M+H]+
EA025305
LC-ESI-ITFT; MS2; CE: 60%; R=7500; [M-H]-
EA025355
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
EA025312
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M-H]-
EA025362
LC-ESI-ITFT; MS2; CE: 75%; R=7500; [M+H]+
EA025306
LC-ESI-ITFT; MS2; CE: 75%; R=7500; [M-H]-
EA025356
LC-ESI-ITFT; MS2; CE: 90%; R=30000; [M+H]+
EA025313
LC-ESI-ITFT; MS2; CE: 90%; R=30000; [M-H]-
EA025363
LC-ESI-ITFT; MS2; CE: 90%; R=7500; [M+H]+
EA025307
LC-ESI-ITFT; MS2; CE: 90%; R=7500; [M-H]-
EA025357
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
SM838051
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
AU231301
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M-H]-
AU231357
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M-H]-
AU325851
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
AU231302
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M-H]-
AU231358
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M-H]-
AU325852
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
AU231303
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M-H]-
AU231359
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M-H]-
AU325853
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
AU231304
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M-H]-
AU231360
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M-H]-
AU325854
LC-ESI-QTOF; MS2; CE: Ramp 19.5-29.2 eV; R=35000; [M+H]+
AU231306
Benthiavalicarb-isopropyl
12 spectra
C18H24FN3O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
381.15225
LC-ESI-QFT; MS2; CE: 15; R=35000; [M+H]+
EQ305501
LC-ESI-QFT; MS2; CE: 15; R=35000; [M-H]-
EQ305551
LC-ESI-QFT; MS2; CE: 30; R=35000; [M+H]+
EQ305502
LC-ESI-QFT; MS2; CE: 30; R=35000; [M-H]-
EQ305552
LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+
EQ305503
LC-ESI-QFT; MS2; CE: 45; R=35000; [M-H]-
EQ305553
LC-ESI-QFT; MS2; CE: 60; R=35000; [M+H]+
EQ305504
LC-ESI-QFT; MS2; CE: 60; R=35000; [M-H]-
EQ305554
LC-ESI-QFT; MS2; CE: 75; R=35000; [M+H]+
EQ305505
LC-ESI-QFT; MS2; CE: 75; R=35000; [M-H]-
EQ305555
LC-ESI-QFT; MS2; CE: 90; R=35000; [M+H]+
EQ305506
LC-ESI-QFT; MS2; CE: 90; R=35000; [M-H]-
EQ305556
BENZ(A)ANTHRACENE
1 spectrum
C18H12
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
228.09390
CI-B; MS
JP012360
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