CID 84981

15546-43-7

Structural Information

Molecular Formula
C36H28N2
SMILES
C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)N(C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C36H28N2/c1-5-13-31(14-6-1)37(32-15-7-2-8-16-32)35-25-21-29(22-26-35)30-23-27-36(28-24-30)38(33-17-9-3-10-18-33)34-19-11-4-12-20-34/h1-28H
InChIKey
DCZNSJVFOQPSRV-UHFFFAOYSA-N
Compound name
N,N-diphenyl-4-[4-(N-phenylanilino)phenyl]aniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

7
References

11839
Patents

488.22525 Da
Monoisotopic Mass

10.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 489.23253 222.9
[M+Na]+ 511.21447 224.3
[M-H]- 487.21797 240.3
[M+NH4]+ 506.25907 227.1
[M+K]+ 527.18841 216.6
[M+H-H2O]+ 471.22251 207.2
[M+HCOO]- 533.22345 245.4
[M+CH3COO]- 547.23910 229.3
[M+Na-2H]- 509.19992 226.1
[M]+ 488.22470 218.9
[M]- 488.22580 218.9
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.