PubChemLite - Peg-14eo (C28H58O14)

Structural Information

Molecular Formula

SMILES

CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO

InChI

InChI=1S/C28H58O14/c1-2-30-5-6-32-9-10-34-13-14-36-17-18-38-21-22-40-25-26-42-28-27-41-24-23-39-20-19-37-16-15-35-12-11-33-8-7-31-4-3-29/h29H,2-28H2,1H3

InChIKey

IPVHOLGRGKTFCL-UHFFFAOYSA-N

Compound name

2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-ethoxyethoxy)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]+	619.38988	264.7
[M+Na]+	641.37182	262.8
[M-H]-	617.37532	253.0
[M+NH4]+	636.41642	267.9
[M+K]+	657.34576	259.6
[M+H-H2O]+	601.37986	264.9
[M+HCOO]-	663.38080	274.4
[M+CH3COO]-	677.39645	254.8
[M+Na-2H]-	639.35727	244.7
[M]+	618.38205	266.6
[M]-	618.38315	266.6

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

619.38988

264.7

[M+Na]+

641.37182

262.8

[M-H]-

617.37532

253.0

[M+NH4]+

636.41642

267.9

[M+K]+

657.34576

259.6

[M+H-H2O]+

601.37986

264.9

[M+HCOO]-

663.38080

274.4

[M+CH3COO]-

677.39645

254.8

[M+Na-2H]-

639.35727

244.7

[M]+

618.38205

266.6

[M]-

618.38315

266.6

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

Peg-14eo

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe