CID 273886

4013-98-3

Structural Information

Molecular Formula

C₁₄H₂₈N₂

SMILES

C1CCC(CC1)NCCNC2CCCCC2

InChI

InChI=1S/C14H28N2/c1-3-7-13(8-4-1)15-11-12-16-14-9-5-2-6-10-14/h13-16H,1-12H2

InChIKey

JMRWVHXGVONXEZ-UHFFFAOYSA-N

Compound name

N,N'-dicyclohexylethane-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 117
Patents: 224.22525 Da
Monoisotopic Mass: 3.0
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]+	225.23253	158.4
[M+Na]+	247.21447	166.2
[M+NH4]+	242.25907	167.6
[M+K]+	263.18841	158.3
[M-H]-	223.21797	163.8
[M+Na-2H]-	245.19992	163.9
[M]+	224.22470	160.6
[M]-	224.22580	160.6

Literature stripe

literature stripe

Patent stripe

patents stripe