CID 135616036

2-(2,4-dichlorophenoxy)-n'-(3-ethoxy-4-hydroxybenzylidene)propanohydrazide

Structural Information

Molecular Formula
C18H18Cl2N2O4
SMILES
CCOC1=C(C=CC(=C1)/C=N/NC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl)O
InChI
InChI=1S/C18H18Cl2N2O4/c1-3-25-17-8-12(4-6-15(17)23)10-21-22-18(24)11(2)26-16-7-5-13(19)9-14(16)20/h4-11,23H,3H2,1-2H3,(H,22,24)/b21-10+
InChIKey
KVHZEXLHHPYMRQ-UFFVCSGVSA-N
Compound name
2-(2,4-dichlorophenoxy)-N-[(E)-(3-ethoxy-4-hydroxyphenyl)methylideneamino]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

396.06436 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 397.07164 188.4
[M+Na]+ 419.05358 196.1
[M-H]- 395.05708 194.8
[M+NH4]+ 414.09818 200.7
[M+K]+ 435.02752 190.9
[M+H-H2O]+ 379.06162 181.7
[M+HCOO]- 441.06256 203.3
[M+CH3COO]- 455.07821 223.5
[M+Na-2H]- 417.03903 188.9
[M]+ 396.06381 195.8
[M]- 396.06491 195.8
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.