CID 9637594

4-((4-chlorobenzyl)oxy)-n'-(2,6-dichlorobenzylidene)benzohydrazide

Structural Information

Molecular Formula
C21H15Cl3N2O2
SMILES
C1=CC(=C(C(=C1)Cl)/C=N/NC(=O)C2=CC=C(C=C2)OCC3=CC=C(C=C3)Cl)Cl
InChI
InChI=1S/C21H15Cl3N2O2/c22-16-8-4-14(5-9-16)13-28-17-10-6-15(7-11-17)21(27)26-25-12-18-19(23)2-1-3-20(18)24/h1-12H,13H2,(H,26,27)/b25-12+
InChIKey
UEAUQBGSIMVVNC-BRJLIKDPSA-N
Compound name
4-[(4-chlorophenyl)methoxy]-N-[(E)-(2,6-dichlorophenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

432.0199 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 433.02718 200.0
[M+Na]+ 455.00912 217.0
[M+NH4]+ 450.05372 208.3
[M+K]+ 470.98306 205.7
[M-H]- 431.01262 207.3
[M+Na-2H]- 452.99457 210.4
[M]+ 432.01935 205.6
[M]- 432.02045 205.6
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.