CID 20898

4762-22-5

Structural Information

Molecular Formula

C₈H₁₇N₅

SMILES

C1CCC(CC1)N=C(N)N=C(N)N

InChI

InChI=1S/C8H17N5/c9-7(10)13-8(11)12-6-4-2-1-3-5-6/h6H,1-5H2,(H6,9,10,11,12,13)

InChIKey

USGCMNLQYSXCDU-UHFFFAOYSA-N

Compound name

2-cyclohexyl-1-(diaminomethylidene)guanidine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 2227
Patents: 183.14839 Da
Monoisotopic Mass: -0.1
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]+	184.15567	142.8
[M+Na]+	206.13761	147.2
[M+NH4]+	201.18221	149.7
[M+K]+	222.11155	143.6
[M-H]-	182.14111	146.2
[M+Na-2H]-	204.12306	146.1
[M]+	183.14784	143.5
[M]-	183.14894	143.5

Literature stripe

literature stripe

Patent stripe

patents stripe