CID 3076805

3h-imidazo(4,5-b)pyridine, 3-(4-chlorophenyl)-2-phenyl-

Structural Information

Molecular Formula
C18H12ClN3
SMILES
C1=CC=C(C=C1)C2=NC3=C(N2C4=CC=C(C=C4)Cl)N=CC=C3
InChI
InChI=1S/C18H12ClN3/c19-14-8-10-15(11-9-14)22-17(13-5-2-1-3-6-13)21-16-7-4-12-20-18(16)22/h1-12H
InChIKey
FBOSTXQUDDGRJH-UHFFFAOYSA-N
Compound name
3-(4-chlorophenyl)-2-phenylimidazo[4,5-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.07196 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.07924 169.7
[M+Na]+ 328.06118 181.8
[M-H]- 304.06468 176.8
[M+NH4]+ 323.10578 183.9
[M+K]+ 344.03512 173.2
[M+H-H2O]+ 288.06922 158.9
[M+HCOO]- 350.07016 186.9
[M+CH3COO]- 364.08581 181.6
[M+Na-2H]- 326.04663 175.9
[M]+ 305.07141 173.1
[M]- 305.07251 173.1
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.