CID 384464

Nsc674266

Structural Information

Molecular Formula
C18H14N2O2
SMILES
COC1=CC=C(C=C1)C2=CN3C4=CC=CC=C4N=C3C(=C2)O
InChI
InChI=1S/C18H14N2O2/c1-22-14-8-6-12(7-9-14)13-10-17(21)18-19-15-4-2-3-5-16(15)20(18)11-13/h2-11,21H,1H3
InChIKey
VKQRBBMSIIKZPC-UHFFFAOYSA-N
Compound name
2-(4-methoxyphenyl)pyrido[1,2-a]benzimidazol-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.10553 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.112806 166.2
[M+Na]+ 313.094748 177.7
[M-H]- 289.098254 172.1
[M+NH4]+ 308.139353 182.5
[M+K]+ 329.068688 171.4
[M+H-H2O]+ 273.102790 157.3
[M+HCOO]- 335.103731 187.0
[M+CH3COO]- 349.119381 178.5
[M+Na-2H]- 311.080196 172.8
[M]+ 290.10498142 169.8
[M]- 290.10607858 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.