CID 9652549

N'-(4-methoxybenzylidene)dodecanohydrazide

Structural Information

Molecular Formula

C₂₀H₃₂N₂O₂

SMILES

CCCCCCCCCCCC(=O)N/N=C/C1=CC=C(C=C1)OC

InChI

InChI=1S/C20H32N2O2/c1-3-4-5-6-7-8-9-10-11-12-20(23)22-21-17-18-13-15-19(24-2)16-14-18/h13-17H,3-12H2,1-2H3,(H,22,23)/b21-17+

InChIKey

XLGSKPJMOAXMRI-HEHNFIMWSA-N

Compound name

N-[(E)-(4-methoxyphenyl)methylideneamino]dodecanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 332.24637 Da
Monoisotopic Mass: 6.3
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]+	333.253646	186.1
[M+Na]+	355.235588	188.7
[M-H]-	331.239094	189.3
[M+NH4]+	350.280193	200.0
[M+K]+	371.209528	185.2
[M+H-H2O]+	315.243630	177.2
[M+HCOO]-	377.244571	210.3
[M+CH3COO]-	391.260221	219.9
[M+Na-2H]-	353.221036	187.5
[M]+	332.24582142	191.4
[M]-	332.24691858	191.4

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.