CID 9637066

N'-(4-((4-chlorobenzyl)oxy)benzylidene)isonicotinohydrazide

Structural Information

Molecular Formula
C20H16ClN3O2
SMILES
C1=CC(=CC=C1COC2=CC=C(C=C2)/C=N/NC(=O)C3=CC=NC=C3)Cl
InChI
InChI=1S/C20H16ClN3O2/c21-18-5-1-16(2-6-18)14-26-19-7-3-15(4-8-19)13-23-24-20(25)17-9-11-22-12-10-17/h1-13H,14H2,(H,24,25)/b23-13+
InChIKey
XBUXMXUSSSYABJ-YDZHTSKRSA-N
Compound name
N-[(E)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.0931 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.10038 186.3
[M+Na]+ 388.08232 202.1
[M+NH4]+ 383.12692 194.0
[M+K]+ 404.05626 192.2
[M-H]- 364.08582 193.6
[M+Na-2H]- 386.06777 198.0
[M]+ 365.09255 190.9
[M]- 365.09365 190.9
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.