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96,350 Hit.
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Name
Formula / Structure
ExactMass
ID
Penicillic Acid
5 spectra
C8H10O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
170.05791
LC-ESI-ITFT; MS2; CE: 10; R=17500; [M+H]+
MSBNK-AAFC-AC000666
LC-ESI-ITFT; MS2; CE: 20; R=17500; [M+H]+
MSBNK-AAFC-AC000667
LC-ESI-ITFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-AAFC-AC000668
LC-ESI-ITFT; MS2; CE: 40; R=17500; [M+H]+
MSBNK-AAFC-AC000669
LC-ESI-ITFT; MS2; CE: 55; R=17500; [M+H]+
MSBNK-AAFC-AC000670
Penicillic acid
9 spectra
C8H10O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
170.05791
LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003374
LC-ESI-ITFT; MS2; CE: 20%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003376
LC-ESI-ITFT; MS2; CE: 30%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003378
LC-ESI-ITFT; MS2; CE: 40%; R=7500; [M+H]+
MSBNK-HBM4EU-HB004021
LC-ESI-ITFT; MS2; CE: 40%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003375
LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M+H]+
MSBNK-HBM4EU-HB004022
LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003377
LC-ESI-ITFT; MS2; CE: 60%; R=7500; [M+H]+
MSBNK-HBM4EU-HB004023
LC-ESI-ITFT; MS2; CE: 60%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003379
Penicillin VK
3 spectra
C16H18N2O5S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
350.09363
ESI-QTOF; MS2; CE: 10; [M+K]+
MSBNK-EPA-ENTACT_AGILENT000522
ESI-QTOF; MS2; CE: 20; [M+K]+
MSBNK-EPA-ENTACT_AGILENT000521
ESI-QTOF; MS2; CE: 40; [M+K]+
MSBNK-EPA-ENTACT_AGILENT000520
Penitrem A
10 spectra
C37H44ClNO6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
633.28571
LC-ESI-ITFT; MS2; CE: 10; R=17500; [M+H]+
MSBNK-AAFC-AC000499
LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003150
LC-ESI-ITFT; MS2; CE: 20%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003151
LC-ESI-ITFT; MS2; CE: 20; R=17500; [M+H]+
MSBNK-AAFC-AC000500
LC-ESI-ITFT; MS2; CE: 30%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003152
LC-ESI-ITFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-AAFC-AC000501
LC-ESI-ITFT; MS2; CE: 35; R=17500; [M+H]+
MSBNK-AAFC-AC000502
LC-ESI-ITFT; MS2; CE: 40%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003153
LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003154
LC-ESI-ITFT; MS2; CE: 60%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003155
Penoxsulam
12 spectra
C16H14F5N5O5S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
483.06360
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU046201
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU046251
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU046202
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU046252
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU046203
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU046253
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU046204
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU046254
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU046205
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU046255
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU046206
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU046256
Pentabromphenol
1 spectrum
C6HBr5O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
483.59442
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM809453
Pentachlorophenol
3 spectra
C6HCl5O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
263.84698
LC-APCI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M-H]-
MSBNK-ACES_SU-AS000062
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111018933
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100511
Pentachlorophenol, Permacide, Fungifen, PCP, Chlor...
3 spectra
C6HCl5O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
266.33801
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS009607
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS009608
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS009609
Pentachlorophenol, Permacide, Fungifen, PCP, Chlor...
1 spectrum
C6HCl5O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
266.33801
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT200960
Pentadecanoic acid
6 spectra
C15H30O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
242.22459
LC-ESI-QTOF; MS2; CE: 10; R=; [M+H]+
MSBNK-BGC_Munich-RP024801
LC-ESI-QTOF; MS2; CE: 20; R=; [M+H]+
MSBNK-BGC_Munich-RP024802
LC-ESI-QTOF; MS2; CE: 40; R=; [M+H]+
MSBNK-BGC_Munich-RP024803
LC-ESI-QTOF; MS2; CE:10 eV; [M-H]-
MSBNK-BS-BS003874
LC-ESI-QTOF; MS2; CE:20 eV; [M-H]-
MSBNK-BS-BS003872
LC-ESI-QTOF; MS2; CE:30 eV; [M-H]-
MSBNK-BS-BS003873
Pentadecanoyl Ethanolamide
3 spectra
C17H35NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
285.26678
LC-ESI-QTOF; MS2; CE: 10; R=; [M+H]+
MSBNK-BGC_Munich-RP002901
LC-ESI-QTOF; MS2; CE: 20; R=; [M+H]+
MSBNK-BGC_Munich-RP002902
LC-ESI-QTOF; MS2; CE: 40; R=; [M+H]+
MSBNK-BGC_Munich-RP002903
Pentaethylene glycol
6 spectra
C10H22O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
238.14160
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU086201
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU086202
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU086203
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU086204
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU086205
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU086206
Pentaethyleneglycol dimethyl ether-candidate
3 spectra
C12H26O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
266.17291
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111027000
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111027001
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111027002
Pentamethylenediamine, pentane-1,5-diamine, 1,5-Pe...
1 spectrum
C5H14N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
102.18100
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT100440
Pentamidine
11 spectra
C19H24N4O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
340.18994
LC-ESI-IT; MS2; m/z: 341; [M+H]+
MSBNK-Keio_Univ-KO009179
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003937
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003938
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003939
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003940
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003941
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
MSBNK-Fiocruz-FIO00450
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
MSBNK-Fiocruz-FIO00451
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
MSBNK-Fiocruz-FIO00452
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
MSBNK-Fiocruz-FIO00453
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
MSBNK-Fiocruz-FIO00454
Pentanoic acid
6 spectra
C5H10O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
102.06808
LC-ESI-IT; MS2; m/z: 101.2; [M-H]-
MSBNK-Metabolon-MT000004
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001991
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001992
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001993
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001994
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001995
Pentasaccharides (Hex-Hex-Hex-Hex-Hex)
1 spectrum
C30H52O26
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
828.71997
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308964
Pentose-Hexose + C10H17
2 spectra
C21H36O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
448.50900
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308950
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308951
Pentose-Hexose + C5H9
1 spectrum
C16H28O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
380.39001
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308942
Pentoxazone
13 spectra
C17H17ClFNO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
353.08301
ESI-QTOF; MS2; NEGATIVE; [M-H]-; 37Cl-isotopolog ion; CID; 20 V
MSBNK-MSSJ-MSJ00286
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 10 V
MSBNK-MSSJ-MSJ00280
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 20 V
MSBNK-MSSJ-MSJ00281
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 30 V
MSBNK-MSSJ-MSJ00282
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 40 V
MSBNK-MSSJ-MSJ00283
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 60 V
MSBNK-MSSJ-MSJ00284
ESI-QTOF; MS2; NEGATIVE; [M-H]-; CID; 80 V
MSBNK-MSSJ-MSJ00285
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 10 V
MSBNK-MSSJ-MSJ00273
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 20 V
MSBNK-MSSJ-MSJ00274
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 30 V
MSBNK-MSSJ-MSJ00275
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 40 V
MSBNK-MSSJ-MSJ00276
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 60 V
MSBNK-MSSJ-MSJ00277
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 80 V
MSBNK-MSSJ-MSJ00278
Pentoxifylline
26 spectra
C13H18N4O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
278.13788
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
MSBNK-UFZ-WANA221411C9CFPH
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
MSBNK-UFZ-WANA221413D9F1PH
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
MSBNK-UFZ-WANA2214155BE0PH
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM861402
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311094289
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL2311094291
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL2311094284
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL2311094293
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL2311094282
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL2311094283
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL2311094280
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311094287
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311094285
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311094279
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311094286
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311094294
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311094281
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311094288
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL2311094292
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL2311094290
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU226701
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU226702
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU226703
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU226704
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU226705
LC-ESI-QTOF; MS2; CE: Ramp 20.8-31.3 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU226706
Peonidin
1 spectrum
[C16H13O6]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
301.07120
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-2H]-
MSBNK-RIKEN-PR100907
Peonidin-3,5-O-di-beta-glucopyranoside
2 spectra
[C28H33O16]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
625.17688
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-2H]-
MSBNK-RIKEN-PR100918
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M]+
MSBNK-RIKEN-PR100459
Peonidin-3,5-O-di-beta-glucoside
26 spectra
[C28H33O16]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
625.55603
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303260
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303263
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303266
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303269
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303272
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303275
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303278
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303281
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303284
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303287
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303290
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303293
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306983
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306987
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306991
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306995
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306998
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307002
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307006
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307010
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307014
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307018
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307022
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307026
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308841
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310531
Peonidin-3-O-alpha-arabinopyranoside
2 spectra
[C21H21O10]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
433.11346
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-2H]-
MSBNK-RIKEN-PR100911
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M]+
MSBNK-RIKEN-PR100453
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