CID 9575536

5-[(e)-[(e)-(3-hydroxy-4-phenoxy-phenyl)methylenehydrazono]methyl]-2-phenoxy-phenol

Structural Information

Molecular Formula
C26H20N2O4
SMILES
C1=CC=C(C=C1)OC2=C(C=C(C=C2)/C=N/N=C/C3=CC(=C(C=C3)OC4=CC=CC=C4)O)O
InChI
InChI=1S/C26H20N2O4/c29-23-15-19(11-13-25(23)31-21-7-3-1-4-8-21)17-27-28-18-20-12-14-26(24(30)16-20)32-22-9-5-2-6-10-22/h1-18,29-30H/b27-17+,28-18+
InChIKey
PVARAWMWHHKBES-XUIWWLCJSA-N
Compound name
5-[(E)-[(E)-(3-hydroxy-4-phenoxyphenyl)methylidenehydrazinylidene]methyl]-2-phenoxyphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

424.1423 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 425.14958 201.7
[M+Na]+ 447.13152 207.3
[M-H]- 423.13502 214.1
[M+NH4]+ 442.17612 209.7
[M+K]+ 463.10546 201.5
[M+H-H2O]+ 407.13956 189.3
[M+HCOO]- 469.14050 227.1
[M+CH3COO]- 483.15615 230.3
[M+Na-2H]- 445.11697 206.3
[M]+ 424.14175 203.3
[M]- 424.14285 203.3
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

No patent data available for this compound.