CID 473689

90690-85-0

Structural Information

Molecular Formula
C24H16Cl2N4
SMILES
C1=CC=C2C(=C1)N=C3C=C(C(=N)C=C3N2C4=CC=C(C=C4)Cl)NC5=CC=C(C=C5)Cl
InChI
InChI=1S/C24H16Cl2N4/c25-15-5-9-17(10-6-15)28-21-14-22-24(13-19(21)27)30(18-11-7-16(26)8-12-18)23-4-2-1-3-20(23)29-22/h1-14,27-28H
InChIKey
AFZIPZIQIQTNQE-UHFFFAOYSA-N
Compound name
N,5-bis(4-chlorophenyl)-3-iminophenazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

7
Patents

430.0752 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 431.08248 200.7
[M+Na]+ 453.06442 211.8
[M-H]- 429.06792 208.4
[M+NH4]+ 448.10902 210.3
[M+K]+ 469.03836 201.1
[M+H-H2O]+ 413.07246 189.1
[M+HCOO]- 475.07340 211.6
[M+CH3COO]- 489.08905 209.4
[M+Na-2H]- 451.04987 207.1
[M]+ 430.07465 203.3
[M]- 430.07575 203.3
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

patents stripe