CID 24701618

N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide hydrochloride

Structural Information

Molecular Formula
C8H13F3N2O
SMILES
C1CC(CNC1)C(=O)NCC(F)(F)F
InChI
InChI=1S/C8H13F3N2O/c9-8(10,11)5-13-7(14)6-2-1-3-12-4-6/h6,12H,1-5H2,(H,13,14)
InChIKey
GAQLVMMYVDZFFL-UHFFFAOYSA-N
Compound name
N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

210.09799 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.10527 147.2
[M+Na]+ 233.08721 152.2
[M+NH4]+ 228.13181 151.6
[M+K]+ 249.06115 148.7
[M-H]- 209.09071 142.6
[M+Na-2H]- 231.07266 148.5
[M]+ 210.09744 145.9
[M]- 210.09854 145.9
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