CID 9669066

2-ethoxy-4-(2-(4-hydroxybenzoyl)carbohydrazonoyl)phenyl 4-methoxybenzoate

Structural Information

Molecular Formula
C24H22N2O6
SMILES
CCOC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC=C(C=C2)O)OC(=O)C3=CC=C(C=C3)OC
InChI
InChI=1S/C24H22N2O6/c1-3-31-22-14-16(15-25-26-23(28)17-5-9-19(27)10-6-17)4-13-21(22)32-24(29)18-7-11-20(30-2)12-8-18/h4-15,27H,3H2,1-2H3,(H,26,28)/b25-15+
InChIKey
LDXJXEFLXVHKMK-MFKUBSTISA-N
Compound name
[2-ethoxy-4-[(E)-[(4-hydroxybenzoyl)hydrazinylidene]methyl]phenyl] 4-methoxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

434.1478 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 435.155076 202.7
[M+Na]+ 457.137018 207.2
[M-H]- 433.140524 212.2
[M+NH4]+ 452.181623 210.7
[M+K]+ 473.110958 204.6
[M+H-H2O]+ 417.145060 191.4
[M+HCOO]- 479.146001 226.4
[M+CH3COO]- 493.161651 233.1
[M+Na-2H]- 455.122466 204.0
[M]+ 434.14725142 207.4
[M]- 434.14834858 207.4
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.