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Name
Formula / Structure
ExactMass
ID
5-METHYL-N-UNDECYL-2-PYRROLIDONE
2 spectra
C16H31NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
253.24055
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004137
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004182
5-Methylbenzotriazole
19 spectra
C7H7N3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
133.06400
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM880101
LC-ESI-QTOF; MS2; CE: 10.0V; [M+H]+
MSBNK-Env_Anal_Chem_U_Tuebingen-TUE00031
LC-ESI-QTOF; MS2; CE: 10.0V; [M-H]-
MSBNK-Env_Anal_Chem_U_Tuebingen-TUE00035
LC-ESI-QTOF; MS2; CE: 10eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN124826
LC-ESI-QTOF; MS2; CE: 15eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN124827
LC-ESI-QTOF; MS2; CE: 20.0V; [M+H]+
MSBNK-Env_Anal_Chem_U_Tuebingen-TUE00032
LC-ESI-QTOF; MS2; CE: 20.0V; [M-H]-
MSBNK-Env_Anal_Chem_U_Tuebingen-TUE00036
LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN124828
LC-ESI-QTOF; MS2; CE: 25eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN124829
LC-ESI-QTOF; MS2; CE: 30eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN124830
LC-ESI-QTOF; MS2; CE: 35eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN124831
LC-ESI-QTOF; MS2; CE: 40.0V; [M+H]+
MSBNK-Env_Anal_Chem_U_Tuebingen-TUE00033
LC-ESI-QTOF; MS2; CE: 40.0V; [M-H]-
MSBNK-Env_Anal_Chem_U_Tuebingen-TUE00037
LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN124832
LC-ESI-QTOF; MS2; CE: 45eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN124833
LC-ESI-QTOF; MS2; CE: 50eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN124834
LC-ESI-QTOF; MS2; CE: 55eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN124835
LC-ESI-QTOF; MS2; CE: 5eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN124825
LC-ESI-QTOF; MS2; CE: 60eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-AN124836
5-Methylcytidine
14 spectra
C10H15N3O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
257.10117
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80503
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80502
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01751
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01784
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01762
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01773
LC-ESI-QTOF; MS2; CE: 10; R=; [M+H]+
MSBNK-BGC_Munich-RP032201
LC-ESI-QTOF; MS2; CE: 10; R=; [M-H]-
MSBNK-BGC_Munich-RP032211
LC-ESI-QTOF; MS2; CE: 20; R=; [M+H]+
MSBNK-BGC_Munich-RP032202
LC-ESI-QTOF; MS2; CE: 20; R=; [M-H]-
MSBNK-BGC_Munich-RP032212
LC-ESI-QTOF; MS2; CE: 40; R=; [M+H]+
MSBNK-BGC_Munich-RP032203
LC-ESI-QTOF; MS2; CE: 40; R=; [M-H]-
MSBNK-BGC_Munich-RP032213
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80501
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80500
5-METHYLCYTOSINE
3 spectra
C5H7N3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
125.05890
LC-ESI-QTOF; MS2; CE: 10eV; R=5000; [M+H]+
MSBNK-Antwerp_Univ-METOX_P200101_F638
LC-ESI-QTOF; MS2; CE: 20eV; R=5000; [M+H]+
MSBNK-Antwerp_Univ-METOX_P200101_EF88
LC-ESI-QTOF; MS2; CE: 40eV; R=5000; [M+H]+
MSBNK-Antwerp_Univ-METOX_P200101_FB57
5-Methylcytosine
11 spectra
C5H7N3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
125.05891
GC-EI-TOF; MS; 2 TMS; BP:254
MSBNK-Kazusa-KZ000010
GC-EI-TOF; MS; 2 TMS; BP:254
MSBNK-Kazusa-KZ000105
GC-EI-TOF; MS; 2 TMS; BP:73
MSBNK-RIKEN-PR010009
GC-EI-TOF; MS; n TMS; RT:576.447 sec
MSBNK-Osaka_Univ-OUF00081
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003362
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003363
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003364
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003365
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003366
LC-ESI-QTOF; MS2; CE:30 V; [M+H]+
MSBNK-RIKEN-PR100017
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+
MSBNK-RIKEN-PR100016
5-METHYLENE-1-PHENYL-6-HEPTEN-3-OL
1 spectrum
C14H18O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
202.13577
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002269
5-METHYLENE-3-PHENYL-6-HEPTEN-3-OL
1 spectrum
C14H18O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
202.13577
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002410
5-METHYLFURFURAL
1 spectrum
C6H6O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
110.03678
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008701
5-METHYLHEXANOIC ACID
1 spectrum
C7H14O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
130.09938
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP009192
5-METHYLINDOLE
1 spectrum
C9H9N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
131.07350
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007833
5-METHYLMERCAPTOTETRAZOLE
1 spectrum
C2H4N4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
116.01567
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008281
5-METHYLPYRIMIDO(3,4-A)INDOLE
1 spectrum
C12H10N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
182.08440
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002001
5-METHYLRESORCINOL
1 spectrum
C7H8O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
124.05243
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004057
5-Methyltetrahydrofolic acid disodium salt, Prefol...
1 spectrum
C20H25N7O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
459.46301
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS003602
5-Methylthioadenosine
8 spectra
C11H15N5O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
297.08957
GC-EI-TOF; MS; n TMS; RT:1034.275 sec
MSBNK-Osaka_Univ-OUF00082
LC-ESI-IT; MS2; m/z: 298; [M+H]+
MSBNK-Keio_Univ-KO008945
LC-ESI-IT; MS3; m/z: 298/163; [M+H]+
MSBNK-Keio_Univ-KO008946
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO002721
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO002722
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO002723
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO002724
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO002725
5-METHYLTHIOPENTANENITRILE
1 spectrum
C6H11NS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
129.06122
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP000921
5-Methyltryptamine
4 spectra
C11H14N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
174.11569
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01281
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01287
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01293
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80505
5-Methyluridine
4 spectra
C10H14N2O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
258.08521
LC-ESI-QTOF; MS2; CE: 10; R=; [M+H]+
MSBNK-BGC_Munich-RP032001
LC-ESI-QTOF; MS2; CE: 10; R=; [M-H]-
MSBNK-BGC_Munich-RP032011
LC-ESI-QTOF; MS2; CE: 20; R=; [M+H]+
MSBNK-BGC_Munich-RP032002
LC-ESI-QTOF; MS2; CE: 40; R=; [M+H]+
MSBNK-BGC_Munich-RP032003
5-Nitro-2-mercaptobenzimidazole
3 spectra
C7H5N3O2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
195.01025
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001894
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001893
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001895
5-NITRO-3-PHENYLINDOLE
1 spectrum
C14H10N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
238.07423
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004413
5-NITROACENAPHTHENE
1 spectrum
C12H9NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
199.06332
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001620
5-Nitroisophthalic acid
9 spectra
C8H5NO6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
211.01169
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000561
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000560
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000559
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU067851
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU067852
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU067853
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU067854
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU067855
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU067856
5-Nitrosalicylic acid
1 spectrum
C7H5NO5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
183.01680
LC-ESI-QFT; MS2; CE:40; R=30000; [M-H]-
MSBNK-ACES_SU-AS000005
5-NONANOL
1 spectrum
C9H20O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
144.15141
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP006560
5-NONANONE
3 spectra
C9H18O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
142.13577
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002580
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP005761
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007041
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