CID 139595635

Ns00095458

Structural Information

Molecular Formula

C₁₆H₃₅NO₈

SMILES

C(CO)NCCOCCOCCOCCOCCOCCOCCO

InChI

InChI=1S/C16H35NO8/c18-3-1-17-2-5-20-7-9-22-11-13-24-15-16-25-14-12-23-10-8-21-6-4-19/h17-19H,1-16H2

InChIKey

JRYCRIUAQIMFHJ-UHFFFAOYSA-N

Compound name

2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 369.23627 Da
Monoisotopic Mass: -2.5
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]+	370.243546	184.0
[M+Na]+	392.225488	184.3
[M-H]-	368.228994	179.0
[M+NH4]+	387.270093	203.1
[M+K]+	408.199428	184.1
[M+H-H2O]+	352.233530	175.5
[M+HCOO]-	414.234471	218.2
[M+CH3COO]-	428.250121	213.0
[M+Na-2H]-	390.210936	186.2
[M]+	369.23572142	196.0
[M]-	369.23681858	196.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.