CID 45075400

3-(3-fluorophenoxy)piperidine

Structural Information

Molecular Formula
C11H14FNO
SMILES
C1CC(CNC1)OC2=CC(=CC=C2)F
InChI
InChI=1S/C11H14FNO/c12-9-3-1-4-10(7-9)14-11-5-2-6-13-8-11/h1,3-4,7,11,13H,2,5-6,8H2
InChIKey
MYUQPFFFBODNTO-UHFFFAOYSA-N
Compound name
3-(3-fluorophenoxy)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

195.10594 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.113216 141.8
[M+Na]+ 218.095158 147.1
[M-H]- 194.098664 143.6
[M+NH4]+ 213.139763 158.7
[M+K]+ 234.069098 143.6
[M+H-H2O]+ 178.103200 133.3
[M+HCOO]- 240.104141 159.2
[M+CH3COO]- 254.119791 179.9
[M+Na-2H]- 216.080606 146.7
[M]+ 195.10539142 134.8
[M]- 195.10648858 134.8
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