CID 16218148

N,n'-diphenyl-n,n'-di-p-tolylbenzene-1,4-diamine

Structural Information

Molecular Formula
C32H28N2
SMILES
CC1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC=C(C=C5)C
InChI
InChI=1S/C32H28N2/c1-25-13-17-29(18-14-25)33(27-9-5-3-6-10-27)31-21-23-32(24-22-31)34(28-11-7-4-8-12-28)30-19-15-26(2)16-20-30/h3-24H,1-2H3
InChIKey
FQNVFRPAQRVHKO-UHFFFAOYSA-N
Compound name
1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3243
Patents

440.22525 Da
Monoisotopic Mass

9.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 441.23253 212.5
[M+Na]+ 463.21447 215.7
[M-H]- 439.21797 228.6
[M+NH4]+ 458.25907 220.0
[M+K]+ 479.18841 209.0
[M+H-H2O]+ 423.22251 198.4
[M+HCOO]- 485.22345 236.1
[M+CH3COO]- 499.23910 220.6
[M+Na-2H]- 461.19992 214.9
[M]+ 440.22470 210.9
[M]- 440.22580 210.9
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.