CID 53930302

4-fluoropiperidin-2-one;hydrochloride

Structural Information

Molecular Formula
C5H8FNO
SMILES
C1CNC(=O)CC1F
InChI
InChI=1S/C5H8FNO/c6-4-1-2-7-5(8)3-4/h4H,1-3H2,(H,7,8)
InChIKey
XGUDIMCVOZNVMA-UHFFFAOYSA-N
Compound name
4-fluoropiperidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

117.05899 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.06627 120.9
[M+Na]+ 140.04821 127.7
[M-H]- 116.05171 120.1
[M+NH4]+ 135.09281 141.3
[M+K]+ 156.02215 126.0
[M+H-H2O]+ 100.05625 114.5
[M+HCOO]- 162.05719 138.9
[M+CH3COO]- 176.07284 165.2
[M+Na-2H]- 138.03366 126.4
[M]+ 117.05844 113.6
[M]- 117.05954 113.6
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