CID 9638105

765274-27-9

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]+ 405.144476 195.3
[M+Na]+ 427.126418 198.4
[M-H]- 403.129924 204.3
[M+NH4]+ 422.171023 203.9
[M+K]+ 443.100358 195.5
[M+H-H2O]+ 387.134460 184.4
[M+HCOO]- 449.135401 218.2
[M+CH3COO]- 463.151051 226.2
[M+Na-2H]- 425.111866 197.2
[M]+ 404.13665142 196.8
[M]- 404.13774858 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.