CID 51060350

N-(3,4-dichlorophenyl)-2-(2-(3-methoxybenzylidene)hydrazino)-2-oxoacetamide

Structural Information

Molecular Formula

C₁₆H₁₃Cl₂N₃O₃

SMILES

COC1=CC=CC(=C1)/C=N/NC(=O)C(=O)NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H13Cl2N3O3/c1-24-12-4-2-3-10(7-12)9-19-21-16(23)15(22)20-11-5-6-13(17)14(18)8-11/h2-9H,1H3,(H,20,22)(H,21,23)/b19-9+

InChIKey

YVHURGHTWCONIC-DJKKODMXSA-N

Compound name

N-(3,4-dichlorophenyl)-N'-[(E)-(3-methoxyphenyl)methylideneamino]oxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 365.0334 Da
Monoisotopic Mass: 3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	366.040676	182.1
[M+Na]+	388.022618	189.9
[M-H]-	364.026124	189.7
[M+NH4]+	383.067223	195.8
[M+K]+	403.996558	184.6
[M+H-H2O]+	348.030660	175.1
[M+HCOO]-	410.031601	200.0
[M+CH3COO]-	424.047251	219.7
[M+Na-2H]-	386.008066	184.8
[M]+	365.03285142	187.3
[M]-	365.03394858	187.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.