CID 10379198

5-benzyl-2-phenyl-5h-imidazo[4,5-c]pyridine

Structural Information

Molecular Formula
C19H15N3
SMILES
C1=CC=C(C=C1)CN2C=CC3=NC(=NC3=C2)C4=CC=CC=C4
InChI
InChI=1S/C19H15N3/c1-3-7-15(8-4-1)13-22-12-11-17-18(14-22)21-19(20-17)16-9-5-2-6-10-16/h1-12,14H,13H2
InChIKey
JCRXLECODBLBHU-UHFFFAOYSA-N
Compound name
5-benzyl-2-phenylimidazo[4,5-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

56
Patents

285.1266 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.13388 167.1
[M+Na]+ 308.11582 176.0
[M-H]- 284.11932 173.7
[M+NH4]+ 303.16042 180.8
[M+K]+ 324.08976 168.8
[M+H-H2O]+ 268.12386 155.9
[M+HCOO]- 330.12480 187.4
[M+CH3COO]- 344.14045 178.2
[M+Na-2H]- 306.10127 173.2
[M]+ 285.12605 166.8
[M]- 285.12715 166.8
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

patents stripe