CID 193156

33451-85-3

Structural Information

Molecular Formula

C₇H₁₉N₃

SMILES

CN(C)CCN(C)CCN

InChI

InChI=1S/C7H19N3/c1-9(2)6-7-10(3)5-4-8/h4-8H2,1-3H3

InChIKey

KRDDBYPPQLOAPV-UHFFFAOYSA-N

Compound name

N'-[2-(dimethylamino)ethyl]-N'-methylethane-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 110
Patents: 145.1579 Da
Monoisotopic Mass: -0.6
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]+	146.165176	136.3
[M+Na]+	168.147118	140.8
[M-H]-	144.150624	138.6
[M+NH4]+	163.191723	157.9
[M+K]+	184.121058	142.7
[M+H-H2O]+	128.155160	129.8
[M+HCOO]-	190.156101	163.0
[M+CH3COO]-	204.171751	191.2
[M+Na-2H]-	166.132566	140.7
[M]+	145.15735142	136.9
[M]-	145.15844858	136.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe