CID 12458282

N-me-n-bis(peg2-oh)

Structural Information

Molecular Formula

C₁₃H₂₉NO₆

SMILES

CN(CCOCCOCCO)CCOCCOCCO

InChI

InChI=1S/C13H29NO6/c1-14(2-6-17-10-12-19-8-4-15)3-7-18-11-13-20-9-5-16/h15-16H,2-13H2,1H3

InChIKey

UMKDFQUNYURFDN-UHFFFAOYSA-N

Compound name

2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-methylamino]ethoxy]ethoxy]ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 295.1995 Da
Monoisotopic Mass: -1.7
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]+	296.206776	170.4
[M+Na]+	318.188718	172.6
[M-H]-	294.192224	167.6
[M+NH4]+	313.233323	184.4
[M+K]+	334.162658	173.2
[M+H-H2O]+	278.196760	163.0
[M+HCOO]-	340.197701	191.7
[M+CH3COO]-	354.213351	203.3
[M+Na-2H]-	316.174166	172.5
[M]+	295.19895142	179.6
[M]-	295.20004858	179.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe