CID 98761

2,2'-[1,4-phenylenebis(methylidynenitrilo)]bis[phenol]

Structural Information

Molecular Formula
C20H16N2O2
SMILES
C1=CC=C(C(=C1)N=CC2=CC=C(C=C2)C=NC3=CC=CC=C3O)O
InChI
InChI=1S/C20H16N2O2/c23-19-7-3-1-5-17(19)21-13-15-9-11-16(12-10-15)14-22-18-6-2-4-8-20(18)24/h1-14,23-24H
InChIKey
VVMRPNQOQNNHGI-UHFFFAOYSA-N
Compound name
2-[[4-[(2-hydroxyphenyl)iminomethyl]phenyl]methylideneamino]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

2
Patents

316.1212 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.12848 173.8
[M+Na]+ 339.11042 180.7
[M-H]- 315.11392 183.7
[M+NH4]+ 334.15502 187.2
[M+K]+ 355.08436 174.8
[M+H-H2O]+ 299.11846 164.0
[M+HCOO]- 361.11940 200.2
[M+CH3COO]- 375.13505 210.7
[M+Na-2H]- 337.09587 179.8
[M]+ 316.12065 173.3
[M]- 316.12175 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