CID 9638105

3-(2-(hydroxy(phenyl)acetyl)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)C(C3=CC=CC=C3)O
InChI
InChI=1S/C23H20N2O5/c1-29-19-12-10-18(11-13-19)23(28)30-20-9-5-6-16(14-20)15-24-25-22(27)21(26)17-7-3-2-4-8-17/h2-15,21,26H,1H3,(H,25,27)/b24-15+
InChIKey
UAMIMHFDSOSWOF-BUVRLJJBSA-N
Compound name
[3-[(E)-[(2-hydroxy-2-phenylacetyl)hydrazinylidene]methyl]phenyl] 4-methoxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

404.1372 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 405.14448 196.5
[M+Na]+ 427.12642 208.3
[M+NH4]+ 422.17102 201.6
[M+K]+ 443.10036 202.0
[M-H]- 403.12992 201.9
[M+Na-2H]- 425.11187 205.2
[M]+ 404.13665 199.4
[M]- 404.13775 199.4
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.