CID 18705586

1-cyclohexylethane-1,2-diamine

Structural Information

Molecular Formula

C₈H₁₈N₂

SMILES

C1CCC(CC1)C(CN)N

InChI

InChI=1S/C8H18N2/c9-6-8(10)7-4-2-1-3-5-7/h7-8H,1-6,9-10H2

InChIKey

ZGITYUSQHMGSRF-UHFFFAOYSA-N

Compound name

1-cyclohexylethane-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 136
Patents: 142.147 Da
Monoisotopic Mass: 0.8
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]+	143.15428	133.2
[M+Na]+	165.13622	141.1
[M+NH4]+	160.18082	142.0
[M+K]+	181.11016	135.9
[M-H]-	141.13972	136.0
[M+Na-2H]-	163.12167	137.6
[M]+	142.14645	134.7
[M]-	142.14755	134.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe