CID 4165923

Steareth-2

Structural Information

Molecular Formula

C₂₂H₄₆O₃

SMILES

CCCCCCCCCCCCCCCCCCOCCOCCO

InChI

InChI=1S/C22H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-24-21-22-25-20-18-23/h23H,2-22H2,1H3

InChIKey

ILCOCZBHMDEIAI-UHFFFAOYSA-N

Compound name

2-(2-octadecoxyethoxy)ethanol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 14061
Patents: 358.3447 Da
Monoisotopic Mass: 8.2
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]+	359.35198	197.8
[M+Na]+	381.33392	204.1
[M+NH4]+	376.37852	202.3
[M+K]+	397.30786	195.2
[M-H]-	357.33742	195.6
[M+Na-2H]-	379.31937	196.8
[M]+	358.34415	197.7
[M]-	358.34525	197.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe