CID 13843003

4-(3-fluorophenyl)piperidine

Structural Information

Molecular Formula

C₁₁H₁₄FN

SMILES

C1CNCCC1C2=CC(=CC=C2)F

InChI

InChI=1S/C11H14FN/c12-11-3-1-2-10(8-11)9-4-6-13-7-5-9/h1-3,8-9,13H,4-7H2

InChIKey

BCYGJJOHAFKLLF-UHFFFAOYSA-N

Compound name

4-(3-fluorophenyl)piperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 221
Patents: 179.11102 Da
Monoisotopic Mass: 2.1
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]+	180.118296	138.5
[M+Na]+	202.100238	143.9
[M-H]-	178.103744	140.3
[M+NH4]+	197.144843	156.1
[M+K]+	218.074178	139.8
[M+H-H2O]+	162.108280	130.3
[M+HCOO]-	224.109221	155.7
[M+CH3COO]-	238.124871	149.8
[M+Na-2H]-	200.085686	143.4
[M]+	179.11047142	130.1
[M]-	179.11156858	130.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe