CID 58361976

3,3,4,4-tetrafluoropiperidine hydrochloride

Structural Information

Molecular Formula
C5H7F4N
SMILES
C1CNCC(C1(F)F)(F)F
InChI
InChI=1S/C5H7F4N/c6-4(7)1-2-10-3-5(4,8)9/h10H,1-3H2
InChIKey
IMZJCMZEADLXAR-UHFFFAOYSA-N
Compound name
3,3,4,4-tetrafluoropiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

157.05147 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.058746 125.5
[M+Na]+ 180.040688 134.1
[M-H]- 156.044194 121.4
[M+NH4]+ 175.085293 148.2
[M+K]+ 196.014628 131.8
[M+H-H2O]+ 140.048730 118.0
[M+HCOO]- 202.049671 140.0
[M+CH3COO]- 216.065321 172.1
[M+Na-2H]- 178.026136 131.5
[M]+ 157.05092142 114.6
[M]- 157.05201858 114.6
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