CID 16218162

N,n'-bis(4-bromophenyl)benzidine

Structural Information

Molecular Formula
C24H18Br2N2
SMILES
C1=CC(=CC=C1C2=CC=C(C=C2)NC3=CC=C(C=C3)Br)NC4=CC=C(C=C4)Br
InChI
InChI=1S/C24H18Br2N2/c25-19-5-13-23(14-6-19)27-21-9-1-17(2-10-21)18-3-11-22(12-4-18)28-24-15-7-20(26)8-16-24/h1-16,27-28H
InChIKey
DXTBWEYORVJILO-UHFFFAOYSA-N
Compound name
4-[4-(4-bromoanilino)phenyl]-N-(4-bromophenyl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

491.98367 Da
Monoisotopic Mass

8.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 492.99095 194.1
[M+Na]+ 514.97289 200.7
[M-H]- 490.97639 206.3
[M+NH4]+ 510.01749 205.2
[M+K]+ 530.94683 184.3
[M+H-H2O]+ 474.98093 198.5
[M+HCOO]- 536.98187 210.2
[M+CH3COO]- 550.99752 204.0
[M+Na-2H]- 512.95834 198.4
[M]+ 491.98312 225.0
[M]- 491.98422 225.0
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

patents stripe