CID 17730749

2-(2,4-dichlorophenoxy)-n'-(4-((4-methylbenzyl)oxy)benzylidene)acetohydrazide

Structural Information

Molecular Formula
C23H20Cl2N2O3
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)/C=N/NC(=O)COC3=C(C=C(C=C3)Cl)Cl
InChI
InChI=1S/C23H20Cl2N2O3/c1-16-2-4-18(5-3-16)14-29-20-9-6-17(7-10-20)13-26-27-23(28)15-30-22-11-8-19(24)12-21(22)25/h2-13H,14-15H2,1H3,(H,27,28)/b26-13+
InChIKey
NNZKWHJYLUJODL-LGJNPRDNSA-N
Compound name
2-(2,4-dichlorophenoxy)-N-[(E)-[4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]acetamide
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 204.7
[M+Na]+ 465.07430 212.2
[M-H]- 441.07780 214.6
[M+NH4]+ 460.11890 215.2
[M+K]+ 481.04824 205.2
[M+H-H2O]+ 425.08234 195.2
[M+HCOO]- 487.08328 221.0
[M+CH3COO]- 501.09893 233.2
[M+Na-2H]- 463.05975 206.2
[M]+ 442.08453 212.2
[M]- 442.08563 212.2
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.