CID 1283206

N-(3,4-dichlorophenyl)piperidine-1-carboxamide

Structural Information

Molecular Formula
C12H14Cl2N2O
SMILES
C1CCN(CC1)C(=O)NC2=CC(=C(C=C2)Cl)Cl
InChI
InChI=1S/C12H14Cl2N2O/c13-10-5-4-9(8-11(10)14)15-12(17)16-6-2-1-3-7-16/h4-5,8H,1-3,6-7H2,(H,15,17)
InChIKey
PNTBDTFSRQFWRY-UHFFFAOYSA-N
Compound name
N-(3,4-dichlorophenyl)piperidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

272.0483 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.055576 158.9
[M+Na]+ 295.037518 165.5
[M-H]- 271.041024 162.7
[M+NH4]+ 290.082123 174.7
[M+K]+ 311.011458 159.9
[M+H-H2O]+ 255.045560 152.2
[M+HCOO]- 317.046501 169.1
[M+CH3COO]- 331.062151 195.8
[M+Na-2H]- 293.022966 161.5
[M]+ 272.04775142 156.9
[M]- 272.04884858 156.9
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