CID 113171

Methanediamine, n-cyclopentyl-

Structural Information

Molecular Formula

C₆H₁₄N₂

SMILES

C1CCC(C1)NCN

InChI

InChI=1S/C6H14N2/c7-5-8-6-3-1-2-4-6/h6,8H,1-5,7H2

InChIKey

QLNNMIUPRPKARZ-UHFFFAOYSA-N

Compound name

N'-cyclopentylmethanediamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 184
Patents: 114.1157 Da
Monoisotopic Mass: 0.2
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]+	115.12298	124.4
[M+Na]+	137.10492	132.2
[M+NH4]+	132.14952	133.5
[M+K]+	153.07886	128.5
[M-H]-	113.10842	126.9
[M+Na-2H]-	135.09037	129.1
[M]+	114.11515	125.8
[M]-	114.11625	125.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe