CID 471645

N-[4-(imidazol-1-ylmethyl)phenyl]-4-phenyl-benzamide

Structural Information

Molecular Formula
C23H19N3O
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)CN4C=CN=C4
InChI
InChI=1S/C23H19N3O/c27-23(21-10-8-20(9-11-21)19-4-2-1-3-5-19)25-22-12-6-18(7-13-22)16-26-15-14-24-17-26/h1-15,17H,16H2,(H,25,27)
InChIKey
QWPJGXHNILVGQF-UHFFFAOYSA-N
Compound name
N-[4-(imidazol-1-ylmethyl)phenyl]-4-phenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.1528 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.16008 184.4
[M+Na]+ 376.14202 190.3
[M-H]- 352.14552 194.3
[M+NH4]+ 371.18662 194.7
[M+K]+ 392.11596 183.2
[M+H-H2O]+ 336.15006 172.6
[M+HCOO]- 398.15100 206.6
[M+CH3COO]- 412.16665 194.1
[M+Na-2H]- 374.12747 187.6
[M]+ 353.15225 183.0
[M]- 353.15335 183.0
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.