CID 45055210

2-ethoxy-4-(2-((2-methoxyphenoxy)ac)carbohydrazonoyl)phenyl 4-methoxybenzoate

Structural Information

Molecular Formula
C26H26N2O7
SMILES
CCOC1=C(C=CC(=C1)/C=N/NC(=O)COC2=CC=CC=C2OC)OC(=O)C3=CC=C(C=C3)OC
InChI
InChI=1S/C26H26N2O7/c1-4-33-24-15-18(9-14-23(24)35-26(30)19-10-12-20(31-2)13-11-19)16-27-28-25(29)17-34-22-8-6-5-7-21(22)32-3/h5-16H,4,17H2,1-3H3,(H,28,29)/b27-16+
InChIKey
NXURXFLWBDJTPE-JVWAILMASA-N
Compound name
[2-ethoxy-4-[(E)-[[2-(2-methoxyphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-methoxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

478.174 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 479.18128 213.9
[M+Na]+ 501.16322 217.6
[M-H]- 477.16672 224.3
[M+NH4]+ 496.20782 220.6
[M+K]+ 517.13716 216.2
[M+H-H2O]+ 461.17126 201.6
[M+HCOO]- 523.17220 238.5
[M+CH3COO]- 537.18785 243.2
[M+Na-2H]- 499.14867 214.8
[M]+ 478.17345 222.3
[M]- 478.17455 222.3
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.