CID 9666282

3-(2-(3-methoxybenzoyl)carbohydrazonoyl)phenyl 4-methoxybenzoate

Structural Information

Molecular Formula
C23H20N2O5
SMILES
COC1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)/C=N/NC(=O)C3=CC(=CC=C3)OC
InChI
InChI=1S/C23H20N2O5/c1-28-19-11-9-17(10-12-19)23(27)30-21-8-3-5-16(13-21)15-24-25-22(26)18-6-4-7-20(14-18)29-2/h3-15H,1-2H3,(H,25,26)/b24-15+
InChIKey
IZZVOEFVIUJJPW-BUVRLJJBSA-N
Compound name
[3-[(E)-[(3-methoxybenzoyl)hydrazinylidene]methyl]phenyl] 4-methoxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

404.1372 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 405.144476 195.8
[M+Na]+ 427.126418 200.7
[M-H]- 403.129924 206.6
[M+NH4]+ 422.171023 205.6
[M+K]+ 443.100358 198.0
[M+H-H2O]+ 387.134460 184.6
[M+HCOO]- 449.135401 221.3
[M+CH3COO]- 463.151051 228.8
[M+Na-2H]- 425.111866 198.5
[M]+ 404.13665142 200.2
[M]- 404.13774858 200.2
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.