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]+ 333.10005 176.3
[M+Na]+ 355.08199 182.8
[M-H]- 331.08549 184.1
[M+NH4]+ 350.12659 190.8
[M+K]+ 371.05593 178.9
[M+H-H2O]+ 315.09003 168.2
[M+HCOO]- 377.09097 197.7
[M+CH3COO]- 391.10662 214.3
[M+Na-2H]- 353.06744 179.6
[M]+ 332.09222 181.5
[M]- 332.09332 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.