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]+ 332.139356 177.5
[M+Na]+ 354.121298 182.4
[M-H]- 330.124804 186.4
[M+NH4]+ 349.165903 188.7
[M+K]+ 370.095238 177.5
[M+H-H2O]+ 314.129340 166.1
[M+HCOO]- 376.130281 203.0
[M+CH3COO]- 390.145931 214.2
[M+Na-2H]- 352.106746 184.5
[M]+ 331.13153142 177.7
[M]- 331.13262858 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.