CID 51060846

4-(allyloxy)-n'-(2-methyl-3-phenyl-2-propenylidene)benzohydrazide

Structural Information

Molecular Formula

C₂₀H₂₀N₂O₂

SMILES

C/C(=C/C1=CC=CC=C1)/C=N/NC(=O)C2=CC=C(C=C2)OCC=C

InChI

InChI=1S/C20H20N2O2/c1-3-13-24-19-11-9-18(10-12-19)20(23)22-21-15-16(2)14-17-7-5-4-6-8-17/h3-12,14-15H,1,13H2,2H3,(H,22,23)/b16-14-,21-15+

InChIKey

XHKHATGQRKLPJU-BAXAEGEVSA-N

Compound name

N-[(E)-[(Z)-2-methyl-3-phenylprop-2-enylidene]amino]-4-prop-2-enoxybenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 320.15247 Da
Monoisotopic Mass: 4.2
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]+	321.159746	178.2
[M+Na]+	343.141688	182.4
[M-H]-	319.145194	185.3
[M+NH4]+	338.186293	191.9
[M+K]+	359.115628	177.7
[M+H-H2O]+	303.149730	168.9
[M+HCOO]-	365.150671	203.3
[M+CH3COO]-	379.166321	214.1
[M+Na-2H]-	341.127136	181.1
[M]+	320.15192142	178.7
[M]-	320.15301858	178.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.