CID 9688455

N-(2-(2-(4-ethoxybenzylidene)hydrazino)-2-oxoethyl)-4-methylbenzamide

Structural Information

Molecular Formula

C₁₉H₂₁N₃O₃

SMILES

CCOC1=CC=C(C=C1)/C=N/NC(=O)CNC(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H21N3O3/c1-3-25-17-10-6-15(7-11-17)12-21-22-18(23)13-20-19(24)16-8-4-14(2)5-9-16/h4-12H,3,13H2,1-2H3,(H,20,24)(H,22,23)/b21-12+

InChIKey

CBAJZNRMLICGKK-CIAFOILYSA-N

Compound name

N-[2-[(2E)-2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]-4-methylbenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 339.1583 Da
Monoisotopic Mass: 2.9
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]+	340.165576	181.2
[M+Na]+	362.147518	185.3
[M-H]-	338.151024	188.7
[M+NH4]+	357.192123	194.0
[M+K]+	378.121458	182.4
[M+H-H2O]+	322.155560	171.4
[M+HCOO]-	384.156501	207.6
[M+CH3COO]-	398.172151	220.5
[M+Na-2H]-	360.132966	184.4
[M]+	339.15775142	183.1
[M]-	339.15884858	183.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.