CID 169671

N5-hydroxy-l-ornithine

Structural Information

Molecular Formula
C5H12N2O3
SMILES
C(C[C@@H](C(=O)O)N)CNO
InChI
InChI=1S/C5H12N2O3/c6-4(5(8)9)2-1-3-7-10/h4,7,10H,1-3,6H2,(H,8,9)/t4-/m0/s1
InChIKey
OZMJDTPATROLQC-BYPYZUCNSA-N
Compound name
(2S)-2-amino-5-(hydroxyamino)pentanoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

10
References

30
Patents

148.0848 Da
Monoisotopic Mass

-4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.092076 131.6
[M+Na]+ 171.074018 136.3
[M-H]- 147.077524 128.6
[M+NH4]+ 166.118623 150.3
[M+K]+ 187.047958 135.8
[M+H-H2O]+ 131.082060 126.2
[M+HCOO]- 193.083001 152.9
[M+CH3COO]- 207.098651 175.2
[M+Na-2H]- 169.059466 134.8
[M]+ 148.08425142 128.2
[M]- 148.08534858 128.2
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