CID 24839165

Brn 5073199

Structural Information

Molecular Formula
C15H14ClN3O
SMILES
CC(C)N1C2=C(N=C(C=C2)Cl)N(C1=O)C3=CC=CC=C3
InChI
InChI=1S/C15H14ClN3O/c1-10(2)18-12-8-9-13(16)17-14(12)19(15(18)20)11-6-4-3-5-7-11/h3-10H,1-2H3
InChIKey
MIHSLXSBQFWZOR-UHFFFAOYSA-N
Compound name
5-chloro-3-phenyl-1-propan-2-ylimidazo[4,5-b]pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.08255 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.08983 162.8
[M+Na]+ 310.07177 180.3
[M+NH4]+ 305.11637 171.2
[M+K]+ 326.04571 173.8
[M-H]- 286.07527 166.2
[M+Na-2H]- 308.05722 171.5
[M]+ 287.08200 166.7
[M]- 287.08310 166.7
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.