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LC-ESI-QQ
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9,615 Hit.
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Name
Formula / Structure
ExactMass
ID
Isobutyric acid
3 spectra
C4H8O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
88.05243
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001180
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001181
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001182
Isobutyryl coenzyme A (C4:0) lithium salt, Isobuty...
11 spectra
C25H42N7O17P3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
837.63599
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026001
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026002
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026003
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026004
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026005
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026006
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026007
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026008
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026009
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026010
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026011
Isoferulic acid
5 spectra
C10H10O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
194.05791
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001211
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001212
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001213
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001214
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001215
Isoguvacine
10 spectra
C6H9NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
127.06333
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003187
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001188
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003188
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001189
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003189
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001190
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003190
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001191
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003191
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001192
Isomaltulose, Palatinose Monohydrate, Glc(alpha1-6...
1 spectrum
C12H22O11
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
342.29700
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS124610
Isonicotinamide
5 spectra
C6H6N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
122.04801
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003232
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003233
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003234
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003235
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003236
Isonicotinic acid
5 spectra
C6H5NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
123.03203
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003192
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003193
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003194
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003195
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003196
Isonicotinic acid hydrazide
10 spectra
C6H7N3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
137.05891
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003247
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001251
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003248
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001252
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003249
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001253
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003250
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001254
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003251
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001255
Isonicotinic acid, INA, 4-Carboxypyridine, 4-Pyrid...
6 spectra
C6H5NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
123.11100
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026201
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026202
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026203
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026204
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026207
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS026208
isookanin-7-glucoside, Flavanomarein, iso-Okanin-7...
10 spectra
C21H22O11
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
450.39600
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS084601
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS084602
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS084603
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS084604
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS084607
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS084608
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS084609
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS084610
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS084611
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS084612
Isoorientin
1 spectrum
C21H20O11
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
448.38000
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PM000407
Isopentenyladenine
2 spectra
C10H15N5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
205.13275
LC-ESI-QQ; MS2; CE:10.0 eV; [M+H]+
MSBNK-RIKEN-PR020105
LC-ESI-QQ; MS2; CE:20.0 eV; [M+H]+
MSBNK-RIKEN-PR020106
Isopentenyladenosine
3 spectra
C15H21N5O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
335.15936
LC-ESI-QQ; MS2; CE:10.0 eV; [M+H]+
MSBNK-RIKEN-PR020107
LC-ESI-QQ; MS2; CE:20.0 eV; [M+H]+
MSBNK-RIKEN-PR020108
LC-ESI-QQ; MS2; CE:30.0 eV; [M+H]+
MSBNK-RIKEN-PR020109
isoPFOA
5 spectra
C8HF15O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
413.97369
LC-ESI-QQ; MS2; CE10eV
MSBNK-PFOS_research_group-FFF00347
LC-ESI-QQ; MS2; CE20eV
MSBNK-PFOS_research_group-FFF00348
LC-ESI-QQ; MS2; CE30eV
MSBNK-PFOS_research_group-FFF00349
LC-ESI-QQ; MS2; CE40eV
MSBNK-PFOS_research_group-FFF00350
LC-ESI-QQ; MS2; CE50eV
MSBNK-PFOS_research_group-FFF00351
isoPFOS
6 spectra
C8HF17O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
499.93750
LC-ESI-QQ; MS2; CE10eV
MSBNK-PFOS_research_group-FFF00299
LC-ESI-QQ; MS2; CE20eV
MSBNK-PFOS_research_group-FFF00300
LC-ESI-QQ; MS2; CE30eV
MSBNK-PFOS_research_group-FFF00301
LC-ESI-QQ; MS2; CE40eV
MSBNK-PFOS_research_group-FFF00302
LC-ESI-QQ; MS2; CE50eV
MSBNK-PFOS_research_group-FFF00303
LC-ESI-QQ; MS2; CE60eV
MSBNK-PFOS_research_group-FFF00304
Isopropanolamine
5 spectra
C3H9NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
75.06841
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003177
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003178
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003179
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003180
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003181
Isopropylacetic acid, 3-Methylbutanoic acid, Isova...
1 spectrum
C5H10O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
102.13300
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS095401
Isoquercetin
1 spectrum
C21H20O12
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
464.37900
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PM000321
Isoquinoline
5 spectra
C9H7N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
129.05785
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003252
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003253
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003254
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003255
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003256
Isor-3-Glc, isorhamnetin-3-O-glucoside, Isorhamnet...
11 spectra
C22H22O12
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
478.40601
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS041901
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS041902
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS041903
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS041904
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS041905
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS041906
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS041907
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS041908
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS041909
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS041910
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS041911
Isorhamnetin
1 spectrum
C16H12O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
316.26501
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PM000337
Isorhamnetin-3-O-galactoside
1 spectrum
C22H22O12
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
478.40601
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PM000327
Isorhamnetin-3-O-glucoside
1 spectrum
C22H22O12
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
478.40601
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PM000328
Isorhamnetin-3-O-glucuronide
1 spectrum
C22H20O13
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
492.38901
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PM000330
Isorhamnetin-3-O-rutinoside
1 spectrum
C28H32O16
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
624.54797
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PM000324
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