CID 354039

1,5-bis(4-chlorophenyl)-2,5-dihydro-2,2-dimethyl-1h-imidazo(4,5-b)phenazine

Structural Information

Molecular Formula
C27H20Cl2N4
SMILES
CC1(N=C2C=C3C(=NC4=CC=CC=C4N3C5=CC=C(C=C5)Cl)C=C2N1C6=CC=C(C=C6)Cl)C
InChI
InChI=1S/C27H20Cl2N4/c1-27(2)31-23-16-25-22(15-26(23)33(27)20-13-9-18(29)10-14-20)30-21-5-3-4-6-24(21)32(25)19-11-7-17(28)8-12-19/h3-16H,1-2H3
InChIKey
HFSRYMCNSIJDJB-UHFFFAOYSA-N
Compound name
1,5-bis(4-chlorophenyl)-2,2-dimethylimidazo[4,5-b]phenazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

470.1065 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 471.11378 215.7
[M+Na]+ 493.09572 229.4
[M-H]- 469.09922 222.3
[M+NH4]+ 488.14032 226.1
[M+K]+ 509.06966 218.1
[M+H-H2O]+ 453.10376 200.9
[M+HCOO]- 515.10470 220.7
[M+CH3COO]- 529.12035 223.6
[M+Na-2H]- 491.08117 217.6
[M]+ 470.10595 221.2
[M]- 470.10705 221.2
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

patents stripe