CID 9591551

2-[2-(2,5-dimethoxybenzylidene)hydrazino]-n-(1-naphthyl)-2-oxoacetamide

Structural Information

Molecular Formula
C21H19N3O4
SMILES
COC1=CC(=C(C=C1)OC)/C=N/NC(=O)C(=O)NC2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C21H19N3O4/c1-27-16-10-11-19(28-2)15(12-16)13-22-24-21(26)20(25)23-18-9-5-7-14-6-3-4-8-17(14)18/h3-13H,1-2H3,(H,23,25)(H,24,26)/b22-13+
InChIKey
DNTMGRIBENZXNH-LPYMAVHISA-N
Compound name
N'-[(E)-(2,5-dimethoxyphenyl)methylideneamino]-N-naphthalen-1-yloxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

377.13754 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.144816 187.4
[M+Na]+ 400.126758 192.7
[M-H]- 376.130264 196.1
[M+NH4]+ 395.171363 199.6
[M+K]+ 416.100698 189.7
[M+H-H2O]+ 360.134800 177.3
[M+HCOO]- 422.135741 212.9
[M+CH3COO]- 436.151391 227.1
[M+Na-2H]- 398.112206 192.6
[M]+ 377.13699142 190.5
[M]- 377.13808858 190.5
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.