CID 2724440

4-(4-fluorobenzoyl)piperidine

Structural Information

Molecular Formula

C₁₂H₁₄FNO

SMILES

C1CNCCC1C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C12H14FNO/c13-11-3-1-9(2-4-11)12(15)10-5-7-14-8-6-10/h1-4,10,14H,5-8H2

InChIKey

ABERUOJGWHYBJL-UHFFFAOYSA-N

Compound name

(4-fluorophenyl)-piperidin-4-ylmethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 1055
Patents: 207.10594 Da
Monoisotopic Mass: 1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	208.11322	145.4
[M+Na]+	230.09516	150.3
[M-H]-	206.09866	147.1
[M+NH4]+	225.13976	161.6
[M+K]+	246.06910	146.4
[M+H-H2O]+	190.10320	137.0
[M+HCOO]-	252.10414	161.6
[M+CH3COO]-	266.11979	182.9
[M+Na-2H]-	228.08061	148.5
[M]+	207.10539	137.5
[M]-	207.10649	137.5

Literature stripe

literature stripe

Patent stripe

patents stripe