CID 5151220

(2-aminoethyl)dipropylamine

Structural Information

Molecular Formula

C₈H₂₀N₂

SMILES

CCCN(CCC)CCN

InChI

InChI=1S/C8H20N2/c1-3-6-10(7-4-2)8-5-9/h3-9H2,1-2H3

InChIKey

DMDXQHYISPCTGF-UHFFFAOYSA-N

Compound name

N',N'-dipropylethane-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1171
Patents: 144.16264 Da
Monoisotopic Mass: 1.1
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]+	145.169916	136.6
[M+Na]+	167.151858	141.4
[M-H]-	143.155364	137.4
[M+NH4]+	162.196463	158.1
[M+K]+	183.125798	141.7
[M+H-H2O]+	127.159900	130.8
[M+HCOO]-	189.160841	161.6
[M+CH3COO]-	203.176491	185.8
[M+Na-2H]-	165.137306	141.1
[M]+	144.16209142	137.2
[M]-	144.16318858	137.2

Literature stripe

literature stripe

Patent stripe

patents stripe