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Name
Formula / Structure
ExactMass
ID
4-Hydroxyphenylpyruvic acid
1 spectrum
C9H8O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
180.04227
EI-B; MS; n TMS; RT: 781.80 s
GLS00093
5-Aminopentanoic acid
1 spectrum
C5H11NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
117.07898
EI-B; MS; 3 TMS; RT: 653.41 s
GLS00074
5-Dehydroquinic acid
1 spectrum
C7H10O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
190.04774
EI-B; MS; n TMS; RT: 779.12 s
GLS00111
5-Hydroxyindoleacetic acid
2 spectra
C10H9NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
191.05824
EI-B; MS; 2 TMS; RT: 906.06 s
GLS00083
EI-B; MS; 3 TMS; RT: 909.78 s
GLS00084
6-Hydroxynicotinic acid
1 spectrum
C6H5NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
139.02695
EI-B; MS; 2 TMS; RT: 622.09 s
GLS00048
Acetylsalicylic acid
1 spectrum
C9H8O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
180.04227
EI-B; MS; n TMS; RT: 592.29 s
GLS00125
Adipic acid
1 spectrum
C6H10O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
146.05791
EI-B; MS; 2 TMS; RT: 585.15 s
GLS00017
Alanylalanine
2 spectra
C6H12N2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
160.08479
EI-B; MS; n TMS; RT: 752.90 s
GLS00098
EI-B; MS; n TMS; RT: 762.80 s
GLS00099
alpha-MethylBenzylamine
2 spectra
C8H11N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
121.08915
EI-B; MS; n TMS; RT: 294.78 s
GLS00001
EI-B; MS; n TMS; RT: 414.72 s
GLS00003
Anthranilic acid
1 spectrum
C7H7NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
137.04768
EI-B; MS; 2 TMS; RT: 645.50 s
GLS00049
Benzoic acid
1 spectrum
C7H6O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
122.03678
EI-B; MS; 1 TMS; RT: 432.56 s
GLS00149
beta-Alanine
1 spectrum
C3H7NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
89.04768
EI-B; MS; 3 TMS; RT: 545.86
GLS00053
beta-Cyano-L-Alanine
1 spectrum
C4H6N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
114.04293
EI-B; MS; n TMS; RT: 512.64 s
GLS00005
beta-Glutamic acid
1 spectrum
C5H9NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
147.05316
EI-B; MS; n TMS; RT: 644.66 s
GLS00067
Bicine
1 spectrum
C6H13NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
163.08446
EI-B; MS; 3 TMS; RT: 682.05 s
GLS00058
Cadaverine
1 spectrum
C5H14N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
102.11570
EI-B; MS; 4 TMS; RT: 755.70 s
GLS00116
Cinnamyl alcohol
1 spectrum
C9H10O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
134.07317
EI-B; MS; n TMS; RT: 542.77 s
GLS00145
Citramalic acid
1 spectrum
C5H8O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
148.03717
EI-B; MS; n TMS; RT: 572.84 s
GLS00155
Cystamine
1 spectrum
C4H12N2S2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
152.04419
EI-B; MS; n TMS; RT: 910.38 s
GLS00117
D-(+)-Fucose
2 spectra
C6H12O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
164.06847
EI-B; MS; n TMS; RT: 709.19 s
GLS00085
EI-B; MS; n TMS; RT: 716.61 s
GLS00086
D-(+)-Xylose
2 spectra
C5H10O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
150.05283
EI-B; MS; 4 TMS; RT: 669.50 s
GLS00169
EI-B; MS; 4 TMS; RT: 674.49 s
GLS00170
D-(-)-alpha-Phenylglycine
1 spectrum
C8H9NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
151.06332
EI-B; MS; 2 TMS; RT: 597.54 s
GLS00007
D-3-Phenyllactic acid
1 spectrum
C9H10O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
166.06299
EI-B; MS; 2 TMS; RT: 632.60 s
GLS00073
D-Arabitol
1 spectrum
C5H12O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
152.06847
EI-B; MS; 5 TMS; RT: 704.48 s
GLS00172
D-Glutamine
1 spectrum
C5H10N2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
146.06914
EI-B; MS; 3 TMS; RT: 723.18 s
GLS00096
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