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]+ 321.170976 175.1
[M+Na]+ 343.152918 185.7
[M-H]- 319.156424 177.4
[M+NH4]+ 338.197523 185.8
[M+K]+ 359.126858 177.6
[M+H-H2O]+ 303.160960 158.1
[M+HCOO]- 365.161901 185.9
[M+CH3COO]- 379.177551 183.3
[M+Na-2H]- 341.138366 176.9
[M]+ 320.16315142 169.8
[M]- 320.16424858 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.