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5,633 Hit.
( 396 - 512 Displayed )
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Name
Formula / Structure
ExactMass
ID
3,4-Methylenedioxy-N-ethylamphetamine (MDEA)
1 spectrum
C12H17NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
207.12593
LC-ESI-QTOF; MS2; CE: RAMP 18.3-27.4 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU171306
3,4-Methylenedioxy-N-methylamphetamine (MDMA)
1 spectrum
C11H15NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
193.11028
LC-ESI-QTOF; MS2; CE: RAMP 17.8-26.7 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU171206
3,6,9,12-Tetraoxatetracosan-1-ol
6 spectra
C20H42O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
362.30322
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU406501
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU406502
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU406503
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU406504
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU406505
LC-ESI-QTOF; MS2; CE: RAMP 20-30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU406506
3-(4-Isopropylphenyl)isobutyraldehyde
7 spectra
C13H18O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
190.13580
GC-APCI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU506301
GC-APCI-QTOF; MS2; CE: 10 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU506306
GC-APCI-QTOF; MS2; CE: 20 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU506307
GC-APCI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU506303
GC-APCI-QTOF; MS2; CE: 30 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU506308
GC-APCI-QTOF; MS2; CE: 40 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU506309
GC-APCI-QTOF; MS2; CE: 50 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU506310
3-(Trimethoxysilyl)propyl methacrylate
5 spectra
C10H20O5Si
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
248.10800
GC-APCI-QTOF; MS2; CE: 10 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU506006
GC-APCI-QTOF; MS2; CE: 20 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU506007
GC-APCI-QTOF; MS2; CE: 30 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU506008
GC-APCI-QTOF; MS2; CE: 40 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU506009
GC-APCI-QTOF; MS2; CE: 50 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU506010
3-Aminoacetophenon
4 spectra
C8H9NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
135.06842
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU243901
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU243902
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU243903
LC-ESI-QTOF; MS2; CE: Ramp 15.7-23.5 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU243906
3-Iodopropynyl butylcarbamate
6 spectra
C8H12INO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
280.99127
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU286801
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU286802
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU286803
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU286804
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU286805
LC-ESI-QTOF; MS2; CE: Ramp 20-30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU286806
3-Nitrobenzenesulfonic acid
4 spectra
C6H5NO5S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
202.98885
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU406751
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU406752
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU406753
LC-ESI-QTOF; MS2; CE: RAMP 10-30 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU406756
3-Phenoxybenzoic acid
1 spectrum
C13H10O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
214.06299
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU200551
4'-Methyl-alpha-pyrrolidinopropiophenone
1 spectrum
C14H19NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
217.14667
LC-ESI-QTOF; MS2; CE: RAMP 18.7-28.0 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU169906
4,4`-Difluorobenzophenonen
10 spectra
C13H8F2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
218.05431
GC-APCI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU502001
GC-APCI-QTOF; MS2; CE: 10 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU502006
GC-APCI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU502002
GC-APCI-QTOF; MS2; CE: 20 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU502007
GC-APCI-QTOF; MS2; CE: 20 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU502008
GC-APCI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU502003
GC-APCI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU502004
GC-APCI-QTOF; MS2; CE: 40 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU502009
GC-APCI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU502005
GC-APCI-QTOF; MS2; CE: 50 eV; R=35000; [M]+
MSBNK-Athens_Univ-AU502010
4,4`-Thiodianiline
6 spectra
C12H12N2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
216.07211
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU242901
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU242902
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU242903
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU242904
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU242905
LC-ESI-QTOF; MS2; CE: Ramp 18.6-27.9 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU242906
4-(Dimethylamino)pyridine
5 spectra
C7H10N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
122.08440
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU248101
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU248102
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU248103
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU248104
LC-ESI-QTOF; MS2; CE: Ramp 15.2-22.8 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU248106
4-Acetamidoantipyrin
6 spectra
C13H15N3O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
245.11642
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU200101
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU200102
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU200103
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU200104
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU200105
LC-ESI-QTOF; MS2; CE: Ramp 19.7-29.5 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU200106
4-Amino-N,N-dimethylbenzenesulfonamide
4 spectra
C8H12N2O2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
200.06195
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU246201
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU246202
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU246203
LC-ESI-QTOF; MS2; CE: Ramp 18.0-27.1 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU246206
4-Aminoantipyrine
6 spectra
C15H23NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
249.17288
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU227001
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU227002
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU227003
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU227004
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU227005
LC-ESI-QTOF; MS2; CE: Ramp 18.1-27.2 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU227006
4-Aminobenzamide
5 spectra
C7H8N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
136.06366
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU276201
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU276202
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU276203
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU276204
LC-ESI-QTOF; MS2; CE: Ramp 15.7-23.6 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU276206
4-Androsten-11beta-ol-3,17-dione
6 spectra
C19H26O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
302.18820
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU282901
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU282902
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU282903
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU282904
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU282905
LC-ESI-QTOF; MS2; CE: Ramp 21.7-32.5 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU282906
4-Androstene-3,17-dione
6 spectra
C19H26O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
286.19327
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU280301
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU280302
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU280303
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU280304
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU280305
LC-ESI-QTOF; MS2; CE: Ramp 21.1-31.7 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU280306
4-Fluorobenzoylpropionic acid
6 spectra
C10H9FO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
196.05357
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU272401
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU272402
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU272403
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU272404
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU272405
LC-ESI-QTOF; MS2; CE: Ramp 17.9-26.8 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU272406
4-Formyl-antipyrine
6 spectra
C12H12N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
216.08987
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU266701
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU266702
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU266703
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU266704
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU266705
LC-ESI-QTOF; MS2; CE: Ramp 18.6-27.9 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU266706
4-Formylaminoantipyrine
5 spectra
C12H13N3O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
231.10078
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU200601
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU200602
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU200603
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU200604
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU200605
4-Hydroxy-1-(2-hydroxyethyl)-2,2,6,6-tetramethylpi...
5 spectra
C11H23NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
201.17288
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU252101
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU252102
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU252103
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU252104
LC-ESI-QTOF; MS2; CE: Ramp 18.1-27.1 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU252106
4-Hydroxy-Benzotriazol
2 spectra
C6H5N3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
135.04326
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU223601
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU223602
4-Hydroxybenzenesulfonic acid
3 spectra
C6H6O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
173.99867
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU406851
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU406852
LC-ESI-QTOF; MS2; CE: RAMP 10-30 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU406856
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