CID 9616685

N'-(4-methoxybenzylidene)cyclohexanecarbohydrazide

Structural Information

Molecular Formula

C₁₅H₂₀N₂O₂

SMILES

COC1=CC=C(C=C1)/C=N/NC(=O)C2CCCCC2

InChI

InChI=1S/C15H20N2O2/c1-19-14-9-7-12(8-10-14)11-16-17-15(18)13-5-3-2-4-6-13/h7-11,13H,2-6H2,1H3,(H,17,18)/b16-11+

InChIKey

VKNBPPXEIXCLMZ-LFIBNONCSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 260.15247 Da
Monoisotopic Mass: 3.2
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]+	261.159746	160.3
[M+Na]+	283.141688	163.2
[M-H]-	259.145194	167.0
[M+NH4]+	278.186293	176.4
[M+K]+	299.115628	161.0
[M+H-H2O]+	243.149730	151.8
[M+HCOO]-	305.150671	183.4
[M+CH3COO]-	319.166321	201.6
[M+Na-2H]-	281.127136	164.1
[M]+	260.15192142	156.8
[M]-	260.15301858	156.8

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.