CID 43219678

1-[2-(4-chlorophenyl)-2-oxoethyl]piperidine-4-carboxamide

Structural Information

Molecular Formula
C14H17ClN2O2
SMILES
C1CN(CCC1C(=O)N)CC(=O)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C14H17ClN2O2/c15-12-3-1-10(2-4-12)13(18)9-17-7-5-11(6-8-17)14(16)19/h1-4,11H,5-9H2,(H2,16,19)
InChIKey
IRIZASCTNCMXSH-UHFFFAOYSA-N
Compound name
1-[2-(4-chlorophenyl)-2-oxoethyl]piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.09787 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.10515 163.5
[M+Na]+ 303.08709 168.7
[M-H]- 279.09059 167.3
[M+NH4]+ 298.13169 177.8
[M+K]+ 319.06103 164.0
[M+H-H2O]+ 263.09513 156.0
[M+HCOO]- 325.09607 176.9
[M+CH3COO]- 339.11172 200.2
[M+Na-2H]- 301.07254 163.7
[M]+ 280.09732 160.3
[M]- 280.09842 160.3
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

No patent data available for this compound.