CID 45120658

2059913-83-4

Structural Information

Molecular Formula

C₉H₁₅N₃

SMILES

C1CC(CCC1C2=NC=CN2)N

InChI

InChI=1S/C9H15N3/c10-8-3-1-7(2-4-8)9-11-5-6-12-9/h5-8H,1-4,10H2,(H,11,12)

InChIKey

DJYYTFMSLFGZJS-UHFFFAOYSA-N

Compound name

4-(1H-imidazol-2-yl)cyclohexan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 165.1266 Da
Monoisotopic Mass: 0.5
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]+	166.13388	137.2
[M+Na]+	188.11582	147.2
[M+NH4]+	183.16042	145.5
[M+K]+	204.08976	143.1
[M-H]-	164.11932	139.8
[M+Na-2H]-	186.10127	143.1
[M]+	165.12605	139.0
[M]-	165.12715	139.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe