CID 15006446

1-(2-hydroxyethyl)piperidin-4-one

Structural Information

Molecular Formula
C7H13NO2
SMILES
C1CN(CCC1=O)CCO
InChI
InChI=1S/C7H13NO2/c9-6-5-8-3-1-7(10)2-4-8/h9H,1-6H2
InChIKey
UIFFSBYMUXSQNX-UHFFFAOYSA-N
Compound name
1-(2-hydroxyethyl)piperidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

143.09464 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.101916 130.3
[M+Na]+ 166.083858 136.2
[M-H]- 142.087364 130.6
[M+NH4]+ 161.128463 149.7
[M+K]+ 182.057798 135.0
[M+H-H2O]+ 126.091900 124.4
[M+HCOO]- 188.092841 149.0
[M+CH3COO]- 202.108491 170.6
[M+Na-2H]- 164.069306 135.4
[M]+ 143.09409142 126.4
[M]- 143.09518858 126.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe