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

10
Patents

195.10594 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.11322 141.8
[M+Na]+ 218.09516 147.1
[M-H]- 194.09866 143.6
[M+NH4]+ 213.13976 158.7
[M+K]+ 234.06910 143.6
[M+H-H2O]+ 178.10320 133.3
[M+HCOO]- 240.10414 159.2
[M+CH3COO]- 254.11979 179.9
[M+Na-2H]- 216.08061 146.7
[M]+ 195.10539 134.8
[M]- 195.10649 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