CID 879497

(4-chlorophenyl)(2-phenyl-4,5-dihydro-1h-imidazol-1-yl)methanone

Structural Information

Molecular Formula
C16H13ClN2O
SMILES
C1CN(C(=N1)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C16H13ClN2O/c17-14-8-6-13(7-9-14)16(20)19-11-10-18-15(19)12-4-2-1-3-5-12/h1-9H,10-11H2
InChIKey
NZWXOWUIMBDPNR-UHFFFAOYSA-N
Compound name
(4-chlorophenyl)-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

284.07166 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.078936 164.2
[M+Na]+ 307.060878 172.8
[M-H]- 283.064384 171.2
[M+NH4]+ 302.105483 179.4
[M+K]+ 323.034818 166.5
[M+H-H2O]+ 267.068920 154.8
[M+HCOO]- 329.069861 180.6
[M+CH3COO]- 343.085511 175.8
[M+Na-2H]- 305.046326 166.5
[M]+ 284.07111142 164.6
[M]- 284.07220858 164.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.