CID 9595363

2-(4-chlorophenoxy)-n'-(4-methoxybenzylidene)propanohydrazide

Structural Information

Molecular Formula
C17H17ClN2O3
SMILES
CC(C(=O)N/N=C/C1=CC=C(C=C1)OC)OC2=CC=C(C=C2)Cl
InChI
InChI=1S/C17H17ClN2O3/c1-12(23-16-9-5-14(18)6-10-16)17(21)20-19-11-13-3-7-15(22-2)8-4-13/h3-12H,1-2H3,(H,20,21)/b19-11+
InChIKey
IVKAFXBDULZGOE-YBFXNURJSA-N
Compound name
2-(4-chlorophenoxy)-N-[(E)-(4-methoxyphenyl)methylideneamino]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

332.09277 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.100046 176.3
[M+Na]+ 355.081988 182.8
[M-H]- 331.085494 184.1
[M+NH4]+ 350.126593 190.8
[M+K]+ 371.055928 178.9
[M+H-H2O]+ 315.090030 168.2
[M+HCOO]- 377.090971 197.7
[M+CH3COO]- 391.106621 214.3
[M+Na-2H]- 353.067436 179.6
[M]+ 332.09222142 181.5
[M]- 332.09331858 181.5
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.