CID 6868906

N'-[4-(benzyloxy)benzylidene]isonicotinohydrazide

Structural Information

Molecular Formula
C20H17N3O2
SMILES
C1=CC=C(C=C1)COC2=CC=C(C=C2)/C=N/NC(=O)C3=CC=NC=C3
InChI
InChI=1S/C20H17N3O2/c24-20(18-10-12-21-13-11-18)23-22-14-16-6-8-19(9-7-16)25-15-17-4-2-1-3-5-17/h1-14H,15H2,(H,23,24)/b22-14+
InChIKey
QVLZZOSLQSNVAU-HYARGMPZSA-N
Compound name
N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

331.13208 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.13936 177.5
[M+Na]+ 354.12130 182.4
[M-H]- 330.12480 186.4
[M+NH4]+ 349.16590 188.7
[M+K]+ 370.09524 177.5
[M+H-H2O]+ 314.12934 166.1
[M+HCOO]- 376.13028 203.0
[M+CH3COO]- 390.14593 214.2
[M+Na-2H]- 352.10675 184.5
[M]+ 331.13153 177.7
[M]- 331.13263 177.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.