CID 11810717

3,3'-(biphenyl-4,4'-diylbis(oxy))dianiline

Structural Information

Molecular Formula
C24H20N2O2
SMILES
C1=CC(=CC(=C1)OC2=CC=C(C=C2)C3=CC=C(C=C3)OC4=CC=CC(=C4)N)N
InChI
InChI=1S/C24H20N2O2/c25-19-3-1-5-23(15-19)27-21-11-7-17(8-12-21)18-9-13-22(14-10-18)28-24-6-2-4-20(26)16-24/h1-16H,25-26H2
InChIKey
UCQABCHSIIXVOY-UHFFFAOYSA-N
Compound name
3-[4-[4-(3-aminophenoxy)phenyl]phenoxy]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5884
Patents

368.15247 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.15975 189.3
[M+Na]+ 391.14169 195.7
[M-H]- 367.14519 201.0
[M+NH4]+ 386.18629 199.5
[M+K]+ 407.11563 189.2
[M+H-H2O]+ 351.14973 178.0
[M+HCOO]- 413.15067 213.5
[M+CH3COO]- 427.16632 199.1
[M+Na-2H]- 389.12714 192.8
[M]+ 368.15192 187.3
[M]- 368.15302 187.3
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