CID 193051

Cyclohexanecarboxamidine hydrochloride

Structural Information

Molecular Formula

C₇H₁₄N₂

SMILES

C1CCC(CC1)C(=N)N

InChI

InChI=1S/C7H14N2/c8-7(9)6-4-2-1-3-5-6/h6H,1-5H2,(H3,8,9)

InChIKey

PBCFZTOCSCULAL-UHFFFAOYSA-N

Compound name

cyclohexanecarboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 388
Patents: 126.1157 Da
Monoisotopic Mass: 1.3
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]+	127.122976	127.8
[M+Na]+	149.104918	131.2
[M-H]-	125.108424	129.9
[M+NH4]+	144.149523	148.5
[M+K]+	165.078858	129.9
[M+H-H2O]+	109.112960	121.9
[M+HCOO]-	171.113901	149.1
[M+CH3COO]-	185.129551	175.3
[M+Na-2H]-	147.090366	132.2
[M]+	126.11515142	118.7
[M]-	126.11624858	118.7

Literature stripe

literature stripe

Patent stripe

patents stripe