CID 9611282

4-(2-benzoylcarbohydrazonoyl)-2-methoxyphenyl 3-phenylacrylate

Structural Information

Molecular Formula
C24H20N2O4
SMILES
COC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC=CC=C2)OC(=O)/C=C/C3=CC=CC=C3
InChI
InChI=1S/C24H20N2O4/c1-29-22-16-19(17-25-26-24(28)20-10-6-3-7-11-20)12-14-21(22)30-23(27)15-13-18-8-4-2-5-9-18/h2-17H,1H3,(H,26,28)/b15-13+,25-17+
InChIKey
GBSKJHUTSGXYMY-NBKMAVCRSA-N
Compound name
[4-[(E)-(benzoylhydrazinylidene)methyl]-2-methoxyphenyl] (E)-3-phenylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

400.1423 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.14958 197.5
[M+Na]+ 423.13152 210.5
[M+NH4]+ 418.17612 203.3
[M+K]+ 439.10546 202.2
[M-H]- 399.13502 203.8
[M+Na-2H]- 421.11697 207.2
[M]+ 400.14175 200.9
[M]- 400.14285 200.9
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.