CID 78058

3,6,9,12,15-pentaoxaheptadecan-1-ol

Structural Information

Molecular Formula
C12H26O6
SMILES
CCOCCOCCOCCOCCOCCO
InChI
InChI=1S/C12H26O6/c1-2-14-5-6-16-9-10-18-12-11-17-8-7-15-4-3-13/h13H,2-12H2,1H3
InChIKey
NJRFAMBTWHGSDE-UHFFFAOYSA-N
Compound name
2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

230
Patents

266.17294 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.18022 162.5
[M+Na]+ 289.16216 169.4
[M+NH4]+ 284.20676 167.0
[M+K]+ 305.13610 164.5
[M-H]- 265.16566 159.1
[M+Na-2H]- 287.14761 162.7
[M]+ 266.17239 162.0
[M]- 266.17349 162.0
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