CID 449178

Glutamine hydroxamate

Structural Information

Molecular Formula
C5H10N2O4
SMILES
C(CC(=O)NO)[C@@H](C(=O)O)N
InChI
InChI=1S/C5H10N2O4/c6-3(5(9)10)1-2-4(8)7-11/h3,11H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
InChIKey
YVGZXTQJQNXIAU-VKHMYHEASA-N
Compound name
(2S)-2-amino-5-(hydroxyamino)-5-oxopentanoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

23
References

172
Patents

162.06406 Da
Monoisotopic Mass

-4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.071336 133.5
[M+Na]+ 185.053278 138.2
[M-H]- 161.056784 130.5
[M+NH4]+ 180.097883 151.4
[M+K]+ 201.027218 138.2
[M+H-H2O]+ 145.061320 128.0
[M+HCOO]- 207.062261 154.2
[M+CH3COO]- 221.077911 176.9
[M+Na-2H]- 183.038726 135.4
[M]+ 162.06351142 130.1
[M]- 162.06460858 130.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe