CID 456286

(3z)-8-chloro-n,5-bis(4-chlorophenyl)-3-ethylimino-phenazin-2-amine

Structural Information

Molecular Formula
C26H19Cl3N4
SMILES
CCN=C1C=C2C(=NC3=C(N2C4=CC=C(C=C4)Cl)C=CC(=C3)Cl)C=C1NC5=CC=C(C=C5)Cl
InChI
InChI=1S/C26H19Cl3N4/c1-2-30-21-15-26-24(14-22(21)31-19-8-3-16(27)4-9-19)32-23-13-18(29)7-12-25(23)33(26)20-10-5-17(28)6-11-20/h3-15,31H,2H2,1H3
InChIKey
YYBWZTHXFDXVJF-UHFFFAOYSA-N
Compound name
8-chloro-N,5-bis(4-chlorophenyl)-3-ethyliminophenazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

492.06754 Da
Monoisotopic Mass

7.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 493.07482 216.3
[M+Na]+ 515.05676 227.5
[M-H]- 491.06026 223.4
[M+NH4]+ 510.10136 224.5
[M+K]+ 531.03070 217.4
[M+H-H2O]+ 475.06480 204.1
[M+HCOO]- 537.06574 222.4
[M+CH3COO]- 551.08139 223.7
[M+Na-2H]- 513.04221 219.8
[M]+ 492.06699 222.0
[M]- 492.06809 222.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.