CID 4063955

2-(3,4-dimethoxyphenyl)-1h-imidazo[4,5-b]phenazine

Structural Information

Molecular Formula
C21H16N4O2
SMILES
COC1=C(C=C(C=C1)C2=NC3=CC4=NC5=CC=CC=C5NC4=CC3=N2)OC
InChI
InChI=1S/C21H16N4O2/c1-26-19-8-7-12(9-20(19)27-2)21-24-17-10-15-16(11-18(17)25-21)23-14-6-4-3-5-13(14)22-15/h3-11,22H,1-2H3
InChIKey
LMVUPWLGKIVNGY-UHFFFAOYSA-N
Compound name
2-(3,4-dimethoxyphenyl)-10H-imidazo[4,5-b]phenazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.12732 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.13460 186.1
[M+Na]+ 379.11654 198.9
[M-H]- 355.12004 190.5
[M+NH4]+ 374.16114 197.6
[M+K]+ 395.09048 190.6
[M+H-H2O]+ 339.12458 174.7
[M+HCOO]- 401.12552 203.6
[M+CH3COO]- 415.14117 196.4
[M+Na-2H]- 377.10199 193.5
[M]+ 356.12677 191.7
[M]- 356.12787 191.7
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.