CID 15660

1761-71-3

Structural Information

Molecular Formula

C₁₃H₂₆N₂

SMILES

C1CC(CCC1CC2CCC(CC2)N)N

InChI

InChI=1S/C13H26N2/c14-12-5-1-10(2-6-12)9-11-3-7-13(15)8-4-11/h10-13H,1-9,14-15H2

InChIKey

DZIHTWJGPDVSGE-UHFFFAOYSA-N

Compound name

4-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 11
References: 61997
Patents: 210.2096 Da
Monoisotopic Mass: 1.9
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]+	211.21688	152.9
[M+Na]+	233.19882	161.1
[M+NH4]+	228.24342	162.1
[M+K]+	249.17276	154.4
[M-H]-	209.20232	158.2
[M+Na-2H]-	231.18427	157.4
[M]+	210.20905	155.2
[M]-	210.21015	155.2

Literature stripe

literature stripe

Patent stripe

patents stripe