CID 51060967

2-((4-chlorobenzyl)oxy)-n'-((4-oxo-4h-chromen-3-yl)methylene)benzohydrazide

Structural Information

Molecular Formula
C24H17ClN2O4
SMILES
C1=CC=C2C(=C1)C(=O)C(=CO2)/C=N/NC(=O)C3=CC=CC=C3OCC4=CC=C(C=C4)Cl
InChI
InChI=1S/C24H17ClN2O4/c25-18-11-9-16(10-12-18)14-30-22-8-4-2-6-20(22)24(29)27-26-13-17-15-31-21-7-3-1-5-19(21)23(17)28/h1-13,15H,14H2,(H,27,29)/b26-13+
InChIKey
BRFBAJGJJXELHG-LGJNPRDNSA-N
Compound name
2-[(4-chlorophenyl)methoxy]-N-[(E)-(4-oxochromen-3-yl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

432.08768 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 433.09496 202.3
[M+Na]+ 455.07690 219.6
[M+NH4]+ 450.12150 209.8
[M+K]+ 471.05084 209.4
[M-H]- 431.08040 211.7
[M+Na-2H]- 453.06235 212.7
[M]+ 432.08713 207.9
[M]- 432.08823 207.9
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.