CID 4060943

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

Structural Information

Molecular Formula
C19H11BrN4
SMILES
C1=CC=C2C(=C1)NC3=CC4=NC(=NC4=CC3=N2)C5=CC(=CC=C5)Br
InChI
InChI=1S/C19H11BrN4/c20-12-5-3-4-11(8-12)19-23-17-9-15-16(10-18(17)24-19)22-14-7-2-1-6-13(14)21-15/h1-10,21H
InChIKey
FEHMSNGCKURVOF-UHFFFAOYSA-N
Compound name
2-(3-bromophenyl)-10H-imidazo[4,5-b]phenazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

374.01672 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.02400 180.3
[M+Na]+ 397.00594 195.5
[M-H]- 373.00944 187.1
[M+NH4]+ 392.05054 195.1
[M+K]+ 412.97988 180.7
[M+H-H2O]+ 357.01398 177.5
[M+HCOO]- 419.01492 196.5
[M+CH3COO]- 433.03057 192.7
[M+Na-2H]- 394.99139 190.0
[M]+ 374.01617 200.6
[M]- 374.01727 200.6
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.