CID 473703

(3e)-n,5-bis(4-chlorophenyl)-3-(2-methoxyethylimino)phenazin-2-amine

Structural Information

Molecular Formula
C27H22Cl2N4O
SMILES
COCCN=C1C=C2C(=NC3=CC=CC=C3N2C4=CC=C(C=C4)Cl)C=C1NC5=CC=C(C=C5)Cl
InChI
InChI=1S/C27H22Cl2N4O/c1-34-15-14-30-23-17-27-25(16-24(23)31-20-10-6-18(28)7-11-20)32-22-4-2-3-5-26(22)33(27)21-12-8-19(29)9-13-21/h2-13,16-17,31H,14-15H2,1H3
InChIKey
CTRBIBTZNSBGIC-UHFFFAOYSA-N
Compound name
N,5-bis(4-chlorophenyl)-3-(2-methoxyethylimino)phenazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

488.11707 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 489.12435 217.5
[M+Na]+ 511.10629 227.3
[M-H]- 487.10979 225.8
[M+NH4]+ 506.15089 225.2
[M+K]+ 527.08023 217.6
[M+H-H2O]+ 471.11433 204.3
[M+HCOO]- 533.11527 228.7
[M+CH3COO]- 547.13092 225.1
[M+Na-2H]- 509.09174 222.6
[M]+ 488.11652 223.7
[M]- 488.11762 223.7
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.