CID 66545138

4-chloro-2-(piperidin-1-yl)aniline

Structural Information

Molecular Formula
C11H15ClN2
SMILES
C1CCN(CC1)C2=C(C=CC(=C2)Cl)N
InChI
InChI=1S/C11H15ClN2/c12-9-4-5-10(13)11(8-9)14-6-2-1-3-7-14/h4-5,8H,1-3,6-7,13H2
InChIKey
LCMXORPWQZAMOD-UHFFFAOYSA-N
Compound name
4-chloro-2-piperidin-1-ylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

210.09238 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.09966 146.6
[M+Na]+ 233.08160 153.2
[M-H]- 209.08510 150.7
[M+NH4]+ 228.12620 164.3
[M+K]+ 249.05554 148.2
[M+H-H2O]+ 193.08964 139.5
[M+HCOO]- 255.09058 162.1
[M+CH3COO]- 269.10623 158.2
[M+Na-2H]- 231.06705 150.6
[M]+ 210.09183 141.9
[M]- 210.09293 141.9
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