CID 11277418

188116-08-7

Structural Information

Molecular Formula
C14H16ClN3O
SMILES
C1CCN(CC1)C2=NC(=O)N(C2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C14H16ClN3O/c15-11-4-6-12(7-5-11)18-10-13(16-14(18)19)17-8-2-1-3-9-17/h4-7H,1-3,8-10H2
InChIKey
YGXIELIREXEJQN-UHFFFAOYSA-N
Compound name
3-(4-chlorophenyl)-5-piperidin-1-yl-4H-imidazol-2-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

7
References

52
Patents

277.09818 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.10546 164.7
[M+Na]+ 300.08740 172.1
[M-H]- 276.09090 169.5
[M+NH4]+ 295.13200 178.8
[M+K]+ 316.06134 166.3
[M+H-H2O]+ 260.09544 154.4
[M+HCOO]- 322.09638 176.9
[M+CH3COO]- 336.11203 174.9
[M+Na-2H]- 298.07285 165.1
[M]+ 277.09763 161.3
[M]- 277.09873 161.3
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.