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5,662 Hit.
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Name
Formula / Structure
ExactMass
ID
ACETONITRILE
3 spectra
C2H3N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
41.02655
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002569
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP003999
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008058
ACETOPHENAZINE
1 spectrum
C23H29N3O2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
411.19806
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP003081
Acetophenazine
5 spectra
C23H29N3O2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
411.19806
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000016
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000017
LC-ESI-QTOF; MS2; CE:30 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000018
LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000019
LC-ESI-QTOF; MS2; CE:50 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000020
ACETOPHENETIDIN
1 spectrum
C10H13NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
179.09464
CI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP003148
Acetophenone
1 spectrum
C8H8O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
120.05750
GC-APCI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU506501
ACETOPHENONE
5 spectra
C8H8O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
120.05751
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001491
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001661
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP003413
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP003538
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007137
ACETOPHENONE 2-METHOXYCARBONYLPHENYLHYDRAZONE
1 spectrum
C16H16N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
268.12119
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP009918
ACETOPHENONE DIETHYL ACETAL
1 spectrum
C12H18O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
194.13068
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008465
ACETOPHENONE DIMETHYL ACETAL
1 spectrum
C10H14O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
166.09938
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008461
Acetosyringone
1 spectrum
C10H12O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
196.20200
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310780
ACETYL ACETONE
1 spectrum
C5H8O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
100.05243
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001689
Acetyl CoA, Acetyl coenzyme A (C2:0)
10 spectra
C23H38N7O17P3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
809.58197
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS016201
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS016202
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS016203
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS016204
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS016205
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS016206
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS016207
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS016208
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS016209
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS016210
ACETYL EUGENOL
1 spectrum
C12H14O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
206.09428
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP000745
ACETYL SALYCYLIC ACID
1 spectrum
C9H8O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
180.04227
CI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP003149
Acetyl tributyl citrate
6 spectra
C20H34O8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
402.22540
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU052301
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU052302
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU052303
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU052304
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU052305
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU052306
ACETYL VANILLIN
1 spectrum
C10H10O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
194.05791
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP006384
Acetyl-CoA
7 spectra
C23H38N7O17P3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
809.12579
LC-ESI-ITFT; MS2; m/z:134.05; NEG
MSBNK-NAIST-KNA00605
LC-ESI-ITFT; MS2; m/z:405.57; POS
MSBNK-NAIST-KNA00207
LC-ESI-ITFT; MS2; m/z:808.12; NEG
MSBNK-NAIST-KNA00606
LC-ESI-ITFT; MS2; m/z:809.12; NEG
MSBNK-NAIST-KNA00607
LC-ESI-ITFT; MS2; m/z:810.13; POS
MSBNK-NAIST-KNA00208
LC-ESI-ITFT; MS; NEG
MSBNK-NAIST-KNA00604
LC-ESI-ITFT; MS; POS
MSBNK-NAIST-KNA00205
Acetyl-Gln-Leu-amide
2 spectra
C13H24N4O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
300.17975
LC-ESI-ITTOF; MS2; [M+H]+
MSBNK-MSSJ-MSJ00006
LC-ESI-ITTOF; MS; Positive
MSBNK-MSSJ-MSJ00005
Acetyl-L-Carnitine
3 spectra
C9H17NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
203.11580
LC-ESI-QTOF; MS2; CE: 10; R=; [M+H]+
MSBNK-BGC_Munich-RP025201
LC-ESI-QTOF; MS2; CE: 20; R=; [M+H]+
MSBNK-BGC_Munich-RP025202
LC-ESI-QTOF; MS2; CE: 40; R=; [M+H]+
MSBNK-BGC_Munich-RP025203
Acetyl-L-carnitine
7 spectra
C9H17NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
203.11575
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 10 V
MSBNK-MSSJ-MSJ00828
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 20 V
MSBNK-MSSJ-MSJ00829
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 30 V
MSBNK-MSSJ-MSJ00830
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 40 V
MSBNK-MSSJ-MSJ00831
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 50 V
MSBNK-MSSJ-MSJ00832
ESI-QTOF; MS2; POSITIVE; [M+H]+; CID; 60 V
MSBNK-MSSJ-MSJ00833
ESI-QTOF; MS; POSITIVE
MSBNK-MSSJ-MSJ00827
Acetyl-sulfamethoxazole
16 spectra
C12H13N3O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
295.06271
LC-ESI-ITFT; MS2; CE: 35; R=15000; [M+H]+
MSBNK-UFZ-UF411703
LC-ESI-ITFT; MS2; CE: 35; R=15000; [M-H]-
MSBNK-UFZ-UF411753
LC-ESI-ITFT; MS2; CE: 55; R=15000; [M+H]+
MSBNK-UFZ-UF411701
LC-ESI-ITFT; MS2; CE: 55; R=15000; [M+H]+
MSBNK-UFZ-UF411704
LC-ESI-ITFT; MS2; CE: 55; R=15000; [M-H]-
MSBNK-UFZ-UF411751
LC-ESI-ITFT; MS2; CE: 55; R=15000; [M-H]-
MSBNK-UFZ-UF411754
LC-ESI-ITFT; MS2; CE: 80; R=15000; [M+H]+
MSBNK-UFZ-UF411702
LC-ESI-ITFT; MS2; CE: 80; R=15000; [M-H]-
MSBNK-UFZ-UF411752
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM858902
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM858951
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU267201
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU267202
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU267203
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU267204
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU267205
LC-ESI-QTOF; MS2; CE: Ramp 21.5-32.2 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU267206
ACETYLACETONE
3 spectra
C5H8O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
100.05243
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP000328
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002576
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004919
Acetylaconitine
13 spectra
C36H49NO12
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
687.78302
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301188
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301191
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301195
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301199
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301203
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301207
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301210
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301214
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301218
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301222
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301226
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301230
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310654
Acetylated camptothecin
1 spectrum
C22H20N2O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
408.41000
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR311100
Acetylcarnitine
1 spectrum
[C9H18NO4]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
204.12358
LC-ESI-IT; MS2; m/z: 204.2; [M]+
MSBNK-Metabolon-MT000036
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