CID 84762556

3,4,4-trifluoropiperidine hydrochloride

Structural Information

Molecular Formula
C5H8F3N
SMILES
C1CNCC(C1(F)F)F
InChI
InChI=1S/C5H8F3N/c6-4-3-9-2-1-5(4,7)8/h4,9H,1-3H2
InChIKey
GDZUZMSGANWHFA-UHFFFAOYSA-N
Compound name
3,4,4-trifluoropiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

139.06088 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.06816 131.3
[M+Na]+ 162.05010 139.5
[M+NH4]+ 157.09470 139.0
[M+K]+ 178.02404 132.5
[M-H]- 138.05360 128.2
[M+Na-2H]- 160.03555 135.6
[M]+ 139.06033 131.3
[M]- 139.06143 131.3
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