CID 4338270

303059-20-3

Structural Information

Molecular Formula
C19H10Cl2N4O2
SMILES
C1=CC=C2C(=C1)N(C3=CC4=NC(=NC4=CC3=[N+]2[O-])C5=C(C=CC=C5Cl)Cl)O
InChI
InChI=1S/C19H10Cl2N4O2/c20-10-4-3-5-11(21)18(10)19-22-12-8-16-17(9-13(12)23-19)25(27)15-7-2-1-6-14(15)24(16)26/h1-9,26H
InChIKey
VHZRPLNQLKKEPC-UHFFFAOYSA-N
Compound name
2-(2,6-dichlorophenyl)-10-hydroxy-5-oxidoimidazo[4,5-b]phenazin-5-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

396.01807 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 397.02535 189.6
[M+Na]+ 419.00729 203.1
[M-H]- 395.01079 191.8
[M+NH4]+ 414.05189 199.7
[M+K]+ 434.98123 189.4
[M+H-H2O]+ 379.01533 183.5
[M+HCOO]- 441.01627 196.6
[M+CH3COO]- 455.03192 209.0
[M+Na-2H]- 416.99274 197.0
[M]+ 396.01752 194.7
[M]- 396.01862 194.7
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.