CID 940242

611197-62-7

Structural Information

Molecular Formula
C19H20N4O
SMILES
CC(C)C1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCOCC4)C#N
InChI
InChI=1S/C19H20N4O/c1-13(2)14-11-18(22-7-9-24-10-8-22)23-17-6-4-3-5-16(17)21-19(23)15(14)12-20/h3-6,11,13H,7-10H2,1-2H3
InChIKey
YKIRKGNHNGOYHU-UHFFFAOYSA-N
Compound name
1-morpholin-4-yl-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.1637 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.17098 175.1
[M+Na]+ 343.15292 185.7
[M-H]- 319.15642 177.4
[M+NH4]+ 338.19752 185.8
[M+K]+ 359.12686 177.6
[M+H-H2O]+ 303.16096 158.1
[M+HCOO]- 365.16190 185.9
[M+CH3COO]- 379.17755 183.3
[M+Na-2H]- 341.13837 176.9
[M]+ 320.16315 169.8
[M]- 320.16425 169.8
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.