CID 56831167

4-(2-iodophenoxy)piperidine

Structural Information

Molecular Formula
C11H14INO
SMILES
C1CNCCC1OC2=CC=CC=C2I
InChI
InChI=1S/C11H14INO/c12-10-3-1-2-4-11(10)14-9-5-7-13-8-6-9/h1-4,9,13H,5-8H2
InChIKey
GEPONZFYXJHBLP-UHFFFAOYSA-N
Compound name
4-(2-iodophenoxy)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.01202 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.01930 150.3
[M+Na]+ 326.00124 148.2
[M-H]- 302.00474 146.0
[M+NH4]+ 321.04584 162.2
[M+K]+ 341.97518 150.8
[M+H-H2O]+ 286.00928 139.0
[M+HCOO]- 348.01022 163.5
[M+CH3COO]- 362.02587 188.6
[M+Na-2H]- 323.98669 143.4
[M]+ 303.01147 142.1
[M]- 303.01257 142.1
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.