CID 2758352

4,4-difluoropiperidine

Structural Information

Molecular Formula
C5H9F2N
SMILES
C1CNCCC1(F)F
InChI
InChI=1S/C5H9F2N/c6-5(7)1-3-8-4-2-5/h8H,1-4H2
InChIKey
MJOUJKDTBGXKIU-UHFFFAOYSA-N
Compound name
4,4-difluoropiperidine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

8987
Patents

121.070305 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.077581 121.9
[M+Na]+ 144.059523 128.4
[M-H]- 120.063029 119.7
[M+NH4]+ 139.104128 143.8
[M+K]+ 160.033463 126.7
[M+H-H2O]+ 104.067565 115.1
[M+HCOO]- 166.068506 138.4
[M+CH3COO]- 180.084156 165.4
[M+Na-2H]- 142.044971 128.5
[M]+ 121.06975642 112.5
[M]- 121.07085358 112.5
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