CID 51060307

N'-(4-((4-cl-benzyl)oxy)-3-ethoxybenzylidene)-2-(4-cl-phenoxy)propanohydrazide

Structural Information

Molecular Formula
C25H24Cl2N2O4
SMILES
CCOC1=C(C=CC(=C1)/C=N/NC(=O)C(C)OC2=CC=C(C=C2)Cl)OCC3=CC=C(C=C3)Cl
InChI
InChI=1S/C25H24Cl2N2O4/c1-3-31-24-14-19(6-13-23(24)32-16-18-4-7-20(26)8-5-18)15-28-29-25(30)17(2)33-22-11-9-21(27)10-12-22/h4-15,17H,3,16H2,1-2H3,(H,29,30)/b28-15+
InChIKey
XXVWZEPNRQSIJH-RWPZCVJISA-N
Compound name
2-(4-chlorophenoxy)-N-[(E)-[4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methylideneamino]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

486.1113 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 487.11858 215.0
[M+Na]+ 509.10052 221.1
[M-H]- 485.10402 224.8
[M+NH4]+ 504.14512 223.6
[M+K]+ 525.07446 215.3
[M+H-H2O]+ 469.10856 205.3
[M+HCOO]- 531.10950 230.0
[M+CH3COO]- 545.12515 241.8
[M+Na-2H]- 507.08597 214.7
[M]+ 486.11075 224.2
[M]- 486.11185 224.2
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.