CID 83131

13093-04-4

Structural Information

Molecular Formula

C₈H₂₀N₂

SMILES

CNCCCCCCNC

InChI

InChI=1S/C8H20N2/c1-9-7-5-3-4-6-8-10-2/h9-10H,3-8H2,1-2H3

InChIKey

MDKQJOKKKZNQDG-UHFFFAOYSA-N

Compound name

N,N'-dimethylhexane-1,6-diamine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 3139
Patents: 144.16264 Da
Monoisotopic Mass: 0.8
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]+	145.16992	134.5
[M+Na]+	167.15186	143.0
[M+NH4]+	162.19646	142.5
[M+K]+	183.12580	136.5
[M-H]-	143.15536	135.5
[M+Na-2H]-	165.13731	138.5
[M]+	144.16209	135.7
[M]-	144.16319	135.7

Literature stripe

literature stripe

Patent stripe

patents stripe