CID 18360061

3-amino-1-hydroxypiperidin-2-one

Structural Information

Molecular Formula
C5H10N2O2
SMILES
C1CC(C(=O)N(C1)O)N
InChI
InChI=1S/C5H10N2O2/c6-4-2-1-3-7(9)5(4)8/h4,9H,1-3,6H2
InChIKey
PNCOVHJMURHEPK-UHFFFAOYSA-N
Compound name
3-amino-1-hydroxypiperidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

130.07423 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.08151 125.5
[M+Na]+ 153.06345 132.4
[M-H]- 129.06695 125.9
[M+NH4]+ 148.10805 145.1
[M+K]+ 169.03739 131.1
[M+H-H2O]+ 113.07149 119.8
[M+HCOO]- 175.07243 145.2
[M+CH3COO]- 189.08808 170.0
[M+Na-2H]- 151.04890 130.1
[M]+ 130.07368 119.4
[M]- 130.07478 119.4
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