CID 9656439

2-(4-ethoxyanilino)-n'-(1-methyl-3-phenyl-2-propenylidene)acetohydrazide

Structural Information

Molecular Formula

C₂₀H₂₃N₃O₂

SMILES

CCOC1=CC=C(C=C1)NCC(=O)N/N=C(\C)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C20H23N3O2/c1-3-25-19-13-11-18(12-14-19)21-15-20(24)23-22-16(2)9-10-17-7-5-4-6-8-17/h4-14,21H,3,15H2,1-2H3,(H,23,24)/b10-9+,22-16+

InChIKey

HAMLUUMYZQUEEA-WQOGHSSVSA-N

Compound name

2-(4-ethoxyanilino)-N-[(E)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 337.17902 Da
Monoisotopic Mass: 3.9
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]+	338.186296	182.5
[M+Na]+	360.168238	185.5
[M-H]-	336.171744	189.5
[M+NH4]+	355.212843	195.2
[M+K]+	376.142178	181.5
[M+H-H2O]+	320.176280	172.7
[M+HCOO]-	382.177221	208.4
[M+CH3COO]-	396.192871	220.1
[M+Na-2H]-	358.153686	185.9
[M]+	337.17847142	183.0
[M]-	337.17956858	183.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.