CID 1203613

4-(4-chlorophenyl)piperidine

Structural Information

Molecular Formula
C11H14ClN
SMILES
C1CNCCC1C2=CC=C(C=C2)Cl
InChI
InChI=1S/C11H14ClN/c12-11-3-1-9(2-4-11)10-5-7-13-8-6-10/h1-4,10,13H,5-8H2
InChIKey
VKQHTSSNSJIMAL-UHFFFAOYSA-N
Compound name
4-(4-chlorophenyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

894
Patents

195.08148 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.088756 142.0
[M+Na]+ 218.070698 148.1
[M-H]- 194.074204 144.9
[M+NH4]+ 213.115303 159.9
[M+K]+ 234.044638 142.7
[M+H-H2O]+ 178.078740 135.3
[M+HCOO]- 240.079681 155.6
[M+CH3COO]- 254.095331 153.4
[M+Na-2H]- 216.056146 147.0
[M]+ 195.08093142 136.8
[M]- 195.08202858 136.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe