CID 3528599

2-(4-chloro-3-nitrophenyl)-1h-imidazo(4,5-b)phenazine

Structural Information

Molecular Formula
C19H10ClN5O2
SMILES
C1=CC=C2C(=C1)NC3=CC4=NC(=NC4=CC3=N2)C5=CC(=C(C=C5)Cl)[N+](=O)[O-]
InChI
InChI=1S/C19H10ClN5O2/c20-11-6-5-10(7-18(11)25(26)27)19-23-16-8-14-15(9-17(16)24-19)22-13-4-2-1-3-12(13)21-14/h1-9,21H
InChIKey
QCQQIVFXMYTOEO-UHFFFAOYSA-N
Compound name
2-(4-chloro-3-nitrophenyl)-10H-imidazo[4,5-b]phenazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

375.0523 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 376.05958 182.7
[M+Na]+ 398.04152 194.1
[M-H]- 374.04502 186.8
[M+NH4]+ 393.08612 192.9
[M+K]+ 414.01546 181.1
[M+H-H2O]+ 358.04956 176.0
[M+HCOO]- 420.05050 196.7
[M+CH3COO]- 434.06615 209.6
[M+Na-2H]- 396.02697 193.2
[M]+ 375.05175 185.7
[M]- 375.05285 185.7
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.