CID 264990

3-hydroxypiperidin-2-one

Structural Information

Molecular Formula
C5H9NO2
SMILES
C1CC(C(=O)NC1)O
InChI
InChI=1S/C5H9NO2/c7-4-2-1-3-6-5(4)8/h4,7H,1-3H2,(H,6,8)
InChIKey
RYKLZUPYJFFNRR-UHFFFAOYSA-N
Compound name
3-hydroxypiperidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1889
Patents

115.06333 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.07061 122.3
[M+Na]+ 138.05255 132.4
[M+NH4]+ 133.09715 130.0
[M+K]+ 154.02649 127.8
[M-H]- 114.05605 122.1
[M+Na-2H]- 136.03800 126.4
[M]+ 115.06278 123.3
[M]- 115.06388 123.3
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