CID 221227

N,n'-bis(salicylidene)-1,2-phenylenediamine

Structural Information

Molecular Formula
C20H16N2O2
SMILES
C1=CC=C(C(=C1)C=NC2=CC=CC=C2N=CC3=CC=CC=C3O)O
InChI
InChI=1S/C20H16N2O2/c23-19-11-5-1-7-15(19)13-21-17-9-3-4-10-18(17)22-14-16-8-2-6-12-20(16)24/h1-14,23-24H
InChIKey
HXFYGSOGECBSOY-UHFFFAOYSA-N
Compound name
2-[[2-[(2-hydroxyphenyl)methylideneamino]phenyl]iminomethyl]phenol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

84
References

431
Patents

316.1212 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.128476 173.8
[M+Na]+ 339.110418 180.7
[M-H]- 315.113924 183.7
[M+NH4]+ 334.155023 187.2
[M+K]+ 355.084358 174.8
[M+H-H2O]+ 299.118460 164.0
[M+HCOO]- 361.119401 200.2
[M+CH3COO]- 375.135051 210.7
[M+Na-2H]- 337.095866 179.8
[M]+ 316.12065142 173.3
[M]- 316.12174858 173.3
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