CID 51060269

N'-(3-(benzyloxy)benzylidene)-2-(4-chlorophenoxy)propanohydrazide

Structural Information

Molecular Formula
C23H21ClN2O3
SMILES
CC(C(=O)N/N=C/C1=CC(=CC=C1)OCC2=CC=CC=C2)OC3=CC=C(C=C3)Cl
InChI
InChI=1S/C23H21ClN2O3/c1-17(29-21-12-10-20(24)11-13-21)23(27)26-25-15-19-8-5-9-22(14-19)28-16-18-6-3-2-4-7-18/h2-15,17H,16H2,1H3,(H,26,27)/b25-15+
InChIKey
JQWKSBDNIKMRNA-MFKUBSTISA-N
Compound name
2-(4-chlorophenoxy)-N-[(E)-(3-phenylmethoxyphenyl)methylideneamino]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

408.12408 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 409.13136 197.9
[M+Na]+ 431.11330 202.8
[M-H]- 407.11680 208.0
[M+NH4]+ 426.15790 208.5
[M+K]+ 447.08724 197.3
[M+H-H2O]+ 391.12134 187.6
[M+HCOO]- 453.12228 218.3
[M+CH3COO]- 467.13793 228.0
[M+Na-2H]- 429.09875 200.6
[M]+ 408.12353 202.5
[M]- 408.12463 202.5
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.