CID 55274302

4-(3-fluoroazetidin-1-yl)piperidine dihydrochloride

Structural Information

Molecular Formula
C8H15FN2
SMILES
C1CNCCC1N2CC(C2)F
InChI
InChI=1S/C8H15FN2/c9-7-5-11(6-7)8-1-3-10-4-2-8/h7-8,10H,1-6H2
InChIKey
QCJPGIFKFKZXAQ-UHFFFAOYSA-N
Compound name
4-(3-fluoroazetidin-1-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

166
Patents

158.12193 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.12921 132.7
[M+Na]+ 181.11115 136.7
[M-H]- 157.11465 132.9
[M+NH4]+ 176.15575 143.6
[M+K]+ 197.08509 137.3
[M+H-H2O]+ 141.11919 119.5
[M+HCOO]- 203.12013 146.6
[M+CH3COO]- 217.13578 177.7
[M+Na-2H]- 179.09660 136.4
[M]+ 158.12138 132.4
[M]- 158.12248 132.4
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