CID 473686

Schembl13258398

Structural Information

Molecular Formula
C30H22N4
SMILES
C1=CC=C(C=C1)NC2=CC3=NC4=CC=CC=C4N(C3=CC2=NC5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C30H22N4/c1-4-12-22(13-5-1)31-26-20-28-30(21-27(26)32-23-14-6-2-7-15-23)34(24-16-8-3-9-17-24)29-19-11-10-18-25(29)33-28/h1-21,31H
InChIKey
NGEVPBTWJARPOC-UHFFFAOYSA-N
Compound name
N,5-diphenyl-3-phenyliminophenazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

438.18445 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 439.19173 207.0
[M+Na]+ 461.17367 213.8
[M-H]- 437.17717 218.5
[M+NH4]+ 456.21827 213.7
[M+K]+ 477.14761 203.6
[M+H-H2O]+ 421.18171 191.7
[M+HCOO]- 483.18265 227.3
[M+CH3COO]- 497.19830 214.6
[M+Na-2H]- 459.15912 215.7
[M]+ 438.18390 204.6
[M]- 438.18500 204.6
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