CID 45055137

2-meo-4-(2-(4-((4-methylbenzyl)oxy)bz)carbohydrazonoyl)phenyl 4-methoxybenzoate

Structural Information

Molecular Formula
C31H28N2O6
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)N/N=C/C3=CC(=C(C=C3)OC(=O)C4=CC=C(C=C4)OC)OC
InChI
InChI=1S/C31H28N2O6/c1-21-4-6-22(7-5-21)20-38-27-15-9-24(10-16-27)30(34)33-32-19-23-8-17-28(29(18-23)37-3)39-31(35)25-11-13-26(36-2)14-12-25/h4-19H,20H2,1-3H3,(H,33,34)/b32-19+
InChIKey
GUFPAZVAMHEQSJ-BIZUNTBRSA-N
Compound name
[2-methoxy-4-[(E)-[[4-[(4-methylphenyl)methoxy]benzoyl]hydrazinylidene]methyl]phenyl] 4-methoxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

524.19476 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 525.20204 230.2
[M+Na]+ 547.18398 244.6
[M+NH4]+ 542.22858 234.9
[M+K]+ 563.15792 235.9
[M-H]- 523.18748 238.6
[M+Na-2H]- 545.16943 240.5
[M]+ 524.19421 234.6
[M]- 524.19531 234.6
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.