CID 19691388

3-(fluoromethyl)piperidine hydrochloride

Structural Information

Molecular Formula
C6H12FN
SMILES
C1CC(CNC1)CF
InChI
InChI=1S/C6H12FN/c7-4-6-2-1-3-8-5-6/h6,8H,1-5H2
InChIKey
XCFQIKQVRXAIEX-UHFFFAOYSA-N
Compound name
3-(fluoromethyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

117.095375 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.102651 124.0
[M+Na]+ 140.084593 129.1
[M-H]- 116.088099 122.6
[M+NH4]+ 135.129198 144.1
[M+K]+ 156.058533 127.3
[M+H-H2O]+ 100.092635 117.2
[M+HCOO]- 162.093576 141.2
[M+CH3COO]- 176.109226 166.1
[M+Na-2H]- 138.070041 129.7
[M]+ 117.09482642 115.9
[M]- 117.09592358 115.9
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