CID 3009981

N-[phenyl-(1-phenylbenzimidazol-2-yl)methyl]acetamide

Structural Information

Molecular Formula
C22H19N3O
SMILES
CC(=O)NC(C1=CC=CC=C1)C2=NC3=CC=CC=C3N2C4=CC=CC=C4
InChI
InChI=1S/C22H19N3O/c1-16(26)23-21(17-10-4-2-5-11-17)22-24-19-14-8-9-15-20(19)25(22)18-12-6-3-7-13-18/h2-15,21H,1H3,(H,23,26)
InChIKey
XJYUNRCLZSQPBU-UHFFFAOYSA-N
Compound name
N-[phenyl-(1-phenylbenzimidazol-2-yl)methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.1528 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.16008 181.3
[M+Na]+ 364.14202 188.4
[M-H]- 340.14552 189.6
[M+NH4]+ 359.18662 193.6
[M+K]+ 380.11596 181.9
[M+H-H2O]+ 324.15006 170.6
[M+HCOO]- 386.15100 202.8
[M+CH3COO]- 400.16665 191.6
[M+Na-2H]- 362.12747 185.6
[M]+ 341.15225 181.9
[M]- 341.15335 181.9
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

No patent data available for this compound.