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SMB_Measured
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11 Hit.
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Name
Formula / Structure
ExactMass
ID
1-Stearoyl-sn-glycero-3-phosphocholine
1 spectrum
C26H54NO7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
523.36377
LC-ESI-QFT; MS2; POSITIVE; generated fron DDA dataset
MSBNK-SMB_Measured-HSA001P0524001
AcetylCarnitine
1 spectrum
C9H17NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
203.11575
LC-ESI-QFT; MS2; POSITIVE; generated fron DDA dataset
MSBNK-SMB_Measured-HSA001P0204000
Citrulline
1 spectrum
C6H13N3O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
175.09569
LC-ESI-QFT; MS2; POSITIVE; generated fron DDA dataset
MSBNK-SMB_Measured-HSA001P0176000
L-Proline
1 spectrum
C5H9NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
115.06333
LC-ESI-QFT; MS2; POSITIVE; generated fron DDA dataset
MSBNK-SMB_Measured-HSA001P0116000
Methionine
1 spectrum
C5H11NO2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
149.05106
LC-ESI-QFT; MS2; POSITIVE; generated fron DDA dataset
MSBNK-SMB_Measured-HSA001P0150001
PC(16:0/0:0)
1 spectrum
C24H50NO7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
495.33249
LC-ESI-QFT; MS2; POSITIVE; generated fron DDA dataset
MSBNK-SMB_Measured-HSA001P0496000
Phenylalanine
1 spectrum
C9H11NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
165.07898
LC-ESI-QFT; MS2; NEGATIVE; generated fron DDA dataset
MSBNK-SMB_Measured-HSA002P0164000
Salicylic acid
1 spectrum
C7H6O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
138.03169
LC-ESI-QFT; MS2; NEGATIVE; generated fron DDA dataset
MSBNK-SMB_Measured-HSA002P0137000
Tryptophan
2 spectra
C11H12N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
204.08987
LC-ESI-QFT; MS2; NEGATIVE; generated fron DDA dataset
MSBNK-SMB_Measured-HSA002P0203001
LC-ESI-QFT; MS2; POSITIVE; generated fron DDA dataset
MSBNK-SMB_Measured-HSA001P0205016
Tyrosine
1 spectrum
C9H11NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
181.07390
LC-ESI-QFT; MS2; NEGATIVE; generated fron DDA dataset
MSBNK-SMB_Measured-HSA002P0180000
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