CID 200568

2267-97-2

Structural Information

Molecular Formula
C13H16FNO
SMILES
CC1(CC(=O)CC(N1)C2=CC=C(C=C2)F)C
InChI
InChI=1S/C13H16FNO/c1-13(2)8-11(16)7-12(15-13)9-3-5-10(14)6-4-9/h3-6,12,15H,7-8H2,1-2H3
InChIKey
CKCURTUTWTUVEM-UHFFFAOYSA-N
Compound name
6-(4-fluorophenyl)-2,2-dimethylpiperidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.1216 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.12888 151.9
[M+Na]+ 244.11082 164.4
[M+NH4]+ 239.15542 161.2
[M+K]+ 260.08476 155.4
[M-H]- 220.11432 154.0
[M+Na-2H]- 242.09627 159.5
[M]+ 221.12105 154.3
[M]- 221.12215 154.3
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

No patent data available for this compound.