CID 51060839

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

Structural Information

Molecular Formula
C21H15Cl3N2O2
SMILES
C1=CC=C(C(=C1)C(=O)N/N=C/C2=C(C=C(C=C2)Cl)Cl)OCC3=CC=C(C=C3)Cl
InChI
InChI=1S/C21H15Cl3N2O2/c22-16-8-5-14(6-9-16)13-28-20-4-2-1-3-18(20)21(27)26-25-12-15-7-10-17(23)11-19(15)24/h1-12H,13H2,(H,26,27)/b25-12+
InChIKey
LNELLXLUQJHPFN-BRJLIKDPSA-N
Compound name
2-[(4-chlorophenyl)methoxy]-N-[(E)-(2,4-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 198.9
[M+Na]+ 455.00912 207.5
[M-H]- 431.01262 207.6
[M+NH4]+ 450.05372 210.1
[M+K]+ 470.98306 199.7
[M+H-H2O]+ 415.01716 190.8
[M+HCOO]- 477.01810 210.2
[M+CH3COO]- 491.03375 229.5
[M+Na-2H]- 452.99457 200.3
[M]+ 432.01935 205.0
[M]- 432.02045 205.0
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.