Spectrum MoNA001884 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
InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)
ZDXPYRJPNDTMRX-UHFFFAOYSA-N
C5H10N2O3
146.06914217999997
O=C(O)C(N)CCC(=N)O

Mass Spectral Metadata

NameValue
MS2
0.32499141376991764
147.077339172363
[M+H]+
LC-ESI-QTOF
Agilent QTOF 6550
20
C5H10N2O3
146.06914
146.06914
qtof_library_rp_pos_proton_sept_2018_dinesh_barupal.msp
positive
1.032840207361681
1.5433537504994557 ppm
2.2699236302514691E-4 Da