CID 16206064

4,4'-(p-phenylenediimino)diphenol

Structural Information

Molecular Formula
C18H16N2O2
SMILES
C1=CC(=CC=C1NC2=CC=C(C=C2)O)NC3=CC=C(C=C3)O
InChI
InChI=1S/C18H16N2O2/c21-17-9-5-15(6-10-17)19-13-1-2-14(4-3-13)20-16-7-11-18(22)12-8-16/h1-12,19-22H
InChIKey
YFJMEBYJCJMELS-UHFFFAOYSA-N
Compound name
4-[4-(4-hydroxyanilino)anilino]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

292.1212 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.12848 165.3
[M+Na]+ 315.11042 171.5
[M-H]- 291.11392 172.8
[M+NH4]+ 310.15502 178.4
[M+K]+ 331.08436 165.6
[M+H-H2O]+ 275.11846 156.6
[M+HCOO]- 337.11940 189.1
[M+CH3COO]- 351.13505 176.1
[M+Na-2H]- 313.09587 171.8
[M]+ 292.12065 162.2
[M]- 292.12175 162.2
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