CID 45055329

N'-(4-((4-chlorobenzyl)oxy)benzylidene)-2-(4-chlorophenoxy)propanohydrazide

Structural Information

Molecular Formula
C23H20Cl2N2O3
SMILES
CC(C(=O)N/N=C/C1=CC=C(C=C1)OCC2=CC=C(C=C2)Cl)OC3=CC=C(C=C3)Cl
InChI
InChI=1S/C23H20Cl2N2O3/c1-16(30-22-12-8-20(25)9-13-22)23(28)27-26-14-17-4-10-21(11-5-17)29-15-18-2-6-19(24)7-3-18/h2-14,16H,15H2,1H3,(H,27,28)/b26-14+
InChIKey
MBLMRBVTGQOIFG-VULFUBBASA-N
Compound name
2-(4-chlorophenoxy)-N-[(E)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

442.08508 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 443.09236 203.8
[M+Na]+ 465.07430 210.1
[M-H]- 441.07780 213.4
[M+NH4]+ 460.11890 213.9
[M+K]+ 481.04824 203.6
[M+H-H2O]+ 425.08234 194.4
[M+HCOO]- 487.08328 219.2
[M+CH3COO]- 501.09893 232.9
[M+Na-2H]- 463.05975 205.0
[M]+ 442.08453 210.5
[M]- 442.08563 210.5
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.