CID 11184506

1-[(3,5-dichlorophenyl)methyl]piperidin-4-amine

Structural Information

Molecular Formula
C12H16Cl2N2
SMILES
C1CN(CCC1N)CC2=CC(=CC(=C2)Cl)Cl
InChI
InChI=1S/C12H16Cl2N2/c13-10-5-9(6-11(14)7-10)8-16-3-1-12(15)2-4-16/h5-7,12H,1-4,8,15H2
InChIKey
PCGNHOFWOUARPN-UHFFFAOYSA-N
Compound name
1-[(3,5-dichlorophenyl)methyl]piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

258.06906 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.07634 157.7
[M+Na]+ 281.05828 165.2
[M-H]- 257.06178 161.1
[M+NH4]+ 276.10288 174.1
[M+K]+ 297.03222 158.7
[M+H-H2O]+ 241.06632 151.2
[M+HCOO]- 303.06726 167.7
[M+CH3COO]- 317.08291 168.3
[M+Na-2H]- 279.04373 159.6
[M]+ 258.06851 155.0
[M]- 258.06961 155.0
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