CID 9635039

N'-(4-((4-chlorobenzyl)oxy)-3-ethoxybenzylidene)-2-(4-f-phenoxy)acetohydrazide

Structural Information

Molecular Formula
C24H22ClFN2O4
SMILES
CCOC1=C(C=CC(=C1)/C=N/NC(=O)COC2=CC=C(C=C2)F)OCC3=CC=C(C=C3)Cl
InChI
InChI=1S/C24H22ClFN2O4/c1-2-30-23-13-18(5-12-22(23)32-15-17-3-6-19(25)7-4-17)14-27-28-24(29)16-31-21-10-8-20(26)9-11-21/h3-14H,2,15-16H2,1H3,(H,28,29)/b27-14+
InChIKey
JQMZTSQTNPPGOE-MZJWZYIUSA-N
Compound name
N-[(E)-[4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methylideneamino]-2-(4-fluorophenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

456.1252 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 457.13248 208.3
[M+Na]+ 479.11442 214.7
[M-H]- 455.11792 217.4
[M+NH4]+ 474.15902 217.4
[M+K]+ 495.08836 208.9
[M+H-H2O]+ 439.12246 196.6
[M+HCOO]- 501.12340 228.4
[M+CH3COO]- 515.13905 237.2
[M+Na-2H]- 477.09987 209.6
[M]+ 456.12465 215.0
[M]- 456.12575 215.0
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.