CID 5414

19327-39-0

Structural Information

Molecular Formula
C16H34O5
SMILES
CCCCCCCCOCCOCCOCCOCCO
InChI
InChI=1S/C16H34O5/c1-2-3-4-5-6-7-9-18-11-13-20-15-16-21-14-12-19-10-8-17/h17H,2-16H2,1H3
InChIKey
FEOZZFHAVXYAMB-UHFFFAOYSA-N
Compound name
2-[2-[2-(2-octoxyethoxy)ethoxy]ethoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

219
Patents

306.24063 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.24791 177.2
[M+Na]+ 329.22985 183.7
[M+NH4]+ 324.27445 181.6
[M+K]+ 345.20379 177.4
[M-H]- 305.23335 174.2
[M+Na-2H]- 327.21530 176.8
[M]+ 306.24008 176.8
[M]- 306.24118 176.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe