CID 689843

N-(2-hydroxybenzylidene)-n'-phenyl-1,4-phenylenediamine

Structural Information

Molecular Formula
C19H16N2O
SMILES
C1=CC=C(C=C1)NC2=CC=C(C=C2)N=CC3=CC=CC=C3O
InChI
InChI=1S/C19H16N2O/c22-19-9-5-4-6-15(19)14-20-16-10-12-18(13-11-16)21-17-7-2-1-3-8-17/h1-14,21-22H
InChIKey
HUAVUSOCXGZAQJ-UHFFFAOYSA-N
Compound name
2-[(4-anilinophenyl)iminomethyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

6
Patents

288.12625 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.133526 166.1
[M+Na]+ 311.115468 172.3
[M-H]- 287.118974 175.6
[M+NH4]+ 306.160073 180.4
[M+K]+ 327.089408 166.4
[M+H-H2O]+ 271.123510 156.6
[M+HCOO]- 333.124451 192.5
[M+CH3COO]- 347.140101 177.6
[M+Na-2H]- 309.100916 173.4
[M]+ 288.12570142 164.2
[M]- 288.12679858 164.2
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