CID 62022101

1-(2,2-difluoroethyl)piperidin-4-ol

Structural Information

Molecular Formula
C7H13F2NO
SMILES
C1CN(CCC1O)CC(F)F
InChI
InChI=1S/C7H13F2NO/c8-7(9)5-10-3-1-6(11)2-4-10/h6-7,11H,1-5H2
InChIKey
ZLNOIWDWSGHFJK-UHFFFAOYSA-N
Compound name
1-(2,2-difluoroethyl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

45
Patents

165.09653 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.10381 137.4
[M+Na]+ 188.08575 145.6
[M+NH4]+ 183.13035 144.0
[M+K]+ 204.05969 140.7
[M-H]- 164.08925 135.1
[M+Na-2H]- 186.07120 140.0
[M]+ 165.09598 137.4
[M]- 165.09708 137.4
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