CID 66930

105-84-0

Structural Information

Molecular Formula

C₇H₁₉N₃

SMILES

CNCCN(C)CCNC

InChI

InChI=1S/C7H19N3/c1-8-4-6-10(3)7-5-9-2/h8-9H,4-7H2,1-3H3

InChIKey

ODZZIKZQNODXFS-UHFFFAOYSA-N

Compound name

N,N'-dimethyl-N'-[2-(methylamino)ethyl]ethane-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 1219
Patents: 145.1579 Da
Monoisotopic Mass: -0.4
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]+	146.16518	135.3
[M+Na]+	168.14712	139.6
[M-H]-	144.15062	136.6
[M+NH4]+	163.19172	156.5
[M+K]+	184.12106	140.4
[M+H-H2O]+	128.15516	129.0
[M+HCOO]-	190.15610	162.1
[M+CH3COO]-	204.17175	188.4
[M+Na-2H]-	166.13257	141.5
[M]+	145.15735	135.7
[M]-	145.15845	135.7

Literature stripe

literature stripe

Patent stripe

patents stripe