Spectrum MoNA035892 for GLUTAMINE

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Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

ClassyFire is a freely accessible computational tool that uses the ChemOnt taxonomy to classify chemical entities based on their structure. ClassyFire combines structure search, IUPAC name parsing, and evaluation of logical expressions to retrieve structural features, which are then mapped to the corresponding ChemOnt classes.

Compound Metadata

NameValue
ZDXPYRJPNDTMRX-VKHMYHEASA-N
C5H10N2O3
146.06914217999997
O=C(O)C(N)CCC(=N)O
InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1

Mass Spectral Metadata

NameValue
1.1520849592336946
MS2
LC-ESI-QTOF
Agilent qTOF 6545
C5H10N2O3
positive
40 eV
Sonnenburg Lab MS2 Library HILIC positive method
Sonnenburg_Lab_qTOF_MS2_Spectra.msp
0.44916479769171075
147.0764182
[M+H]+
4.718499460749562 ppm
-6.93979999965677E-4 Da