CID 66931

105-93-1

Structural Information

Molecular Formula

C₁₀H₂₅N₃

SMILES

CCNCCN(CC)CCNCC

InChI

InChI=1S/C10H25N3/c1-4-11-7-9-13(6-3)10-8-12-5-2/h11-12H,4-10H2,1-3H3

InChIKey

ICDOTLXZHXEZNU-UHFFFAOYSA-N

Compound name

N,N'-diethyl-N'-[2-(ethylamino)ethyl]ethane-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 57
Patents: 187.20485 Da
Monoisotopic Mass: 0.5
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]+	188.21213	147.7
[M+Na]+	210.19407	154.7
[M+NH4]+	205.23867	155.1
[M+K]+	226.16801	148.6
[M-H]-	186.19757	149.2
[M+Na-2H]-	208.17952	151.0
[M]+	187.20430	148.7
[M]-	187.20540	148.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe