CID 38068

Brn 1293481

Structural Information

Molecular Formula
C16H21F3N2O
SMILES
CC(CNC(=O)C(F)(F)F)C1=CC=C(C=C1)N2CCCCC2
InChI
InChI=1S/C16H21F3N2O/c1-12(11-20-15(22)16(17,18)19)13-5-7-14(8-6-13)21-9-3-2-4-10-21/h5-8,12H,2-4,9-11H2,1H3,(H,20,22)
InChIKey
FNHREEMAUFSJRN-UHFFFAOYSA-N
Compound name
2,2,2-trifluoro-N-[2-(4-piperidin-1-ylphenyl)propyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

314.16058 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.16786 174.6
[M+Na]+ 337.14980 181.2
[M+NH4]+ 332.19440 179.0
[M+K]+ 353.12374 176.1
[M-H]- 313.15330 172.6
[M+Na-2H]- 335.13525 177.8
[M]+ 314.16003 174.5
[M]- 314.16113 174.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.