Mpeg18-oh (C37H76O19)

Structural Information

Molecular Formula

SMILES

COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO

InChI

InChI=1S/C37H76O19/c1-39-4-5-41-8-9-43-12-13-45-16-17-47-20-21-49-24-25-51-28-29-53-32-33-55-36-37-56-35-34-54-31-30-52-27-26-50-23-22-48-19-18-46-15-14-44-11-10-42-7-6-40-3-2-38/h38H,2-37H2,1H3

InChIKey

UCMLBGMTMUQKFK-UHFFFAOYSA-N

Compound name

2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol

Related CIDs

2D Structure

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]+	825.505376	321.0
[M+Na]+	847.487318	314.9
[M-H]-	823.490824	308.9
[M+NH4]+	842.531923	327.6
[M+K]+	863.461258	314.7
[M+H-H2O]+	807.495360	320.5
[M+HCOO]-	869.496301	326.0
[M+CH3COO]-	883.511951	285.0
[M+Na-2H]-	845.472766	294.6
[M]+	824.49755142	327.1
[M]-	824.49864858	327.1

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

825.505376

321.0

[M+Na]+

847.487318

314.9

[M-H]-

823.490824

308.9

[M+NH4]+

842.531923

327.6

[M+K]+

863.461258

314.7

[M+H-H2O]+

807.495360

320.5

[M+HCOO]-

869.496301

326.0

[M+CH3COO]-

883.511951

285.0

[M+Na-2H]-

845.472766

294.6

[M]+

824.49755142

327.1

[M]-

824.49864858

327.1

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

Mpeg18-oh

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe