CID 95562

2-amino-5-hydroxypentanoic acid

Structural Information

Molecular Formula
C5H11NO3
SMILES
C(CC(C(=O)O)N)CO
InChI
InChI=1S/C5H11NO3/c6-4(5(8)9)2-1-3-7/h4,7H,1-3,6H2,(H,8,9)
InChIKey
CZWARROQQFCFJB-UHFFFAOYSA-N
Compound name
2-amino-5-hydroxypentanoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

24
References

1563
Patents

133.0739 Da
Monoisotopic Mass

-4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.08118 128.4
[M+Na]+ 156.06312 134.1
[M-H]- 132.06662 125.5
[M+NH4]+ 151.10772 148.1
[M+K]+ 172.03706 133.5
[M+H-H2O]+ 116.07116 123.7
[M+HCOO]- 178.07210 148.8
[M+CH3COO]- 192.08775 170.0
[M+Na-2H]- 154.04857 131.4
[M]+ 133.07335 125.9
[M]- 133.07445 125.9
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