CID 70611945

2839128-55-9

Structural Information

Molecular Formula

C₇H₁₅N₃

SMILES

C1CC(CCC1C(=N)N)N

InChI

InChI=1S/C7H15N3/c8-6-3-1-5(2-4-6)7(9)10/h5-6H,1-4,8H2,(H3,9,10)

InChIKey

GPICYDRYLKCMDX-UHFFFAOYSA-N

Compound name

4-aminocyclohexane-1-carboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 141.1266 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]+	142.13388	131.2
[M+Na]+	164.11582	134.9
[M-H]-	140.11932	133.2
[M+NH4]+	159.16042	151.1
[M+K]+	180.08976	133.2
[M+H-H2O]+	124.12386	125.2
[M+HCOO]-	186.12480	153.0
[M+CH3COO]-	200.14045	181.1
[M+Na-2H]-	162.10127	134.2
[M]+	141.12605	120.8
[M]-	141.12715	120.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe