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 195.3
[M+Na]+ 427.12642 198.4
[M-H]- 403.12992 204.3
[M+NH4]+ 422.17102 203.9
[M+K]+ 443.10036 195.5
[M+H-H2O]+ 387.13446 184.4
[M+HCOO]- 449.13540 218.2
[M+CH3COO]- 463.15105 226.2
[M+Na-2H]- 425.11187 197.2
[M]+ 404.13665 196.8
[M]- 404.13775 196.8
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.