CID 60861625

1-(2,4-dichlorophenyl)piperidin-4-amine

Structural Information

Molecular Formula
C11H14Cl2N2
SMILES
C1CN(CCC1N)C2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C11H14Cl2N2/c12-8-1-2-11(10(13)7-8)15-5-3-9(14)4-6-15/h1-2,7,9H,3-6,14H2
InChIKey
WQSPQMDXJQLZCQ-UHFFFAOYSA-N
Compound name
1-(2,4-dichlorophenyl)piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

244.0534 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.06068 153.2
[M+Na]+ 267.04262 161.1
[M-H]- 243.04612 156.7
[M+NH4]+ 262.08722 170.2
[M+K]+ 283.01656 154.9
[M+H-H2O]+ 227.05066 146.9
[M+HCOO]- 289.05160 163.5
[M+CH3COO]- 303.06725 164.3
[M+Na-2H]- 265.02807 155.6
[M]+ 244.05285 150.1
[M]- 244.05395 150.1
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

patents stripe