CID 45453

2-hexyloxy-2-ethoxyethyl ether

Structural Information

Molecular Formula
C20H42O5
SMILES
CCCCCCOC(COCC(OCC)OCCCCCC)OCC
InChI
InChI=1S/C20H42O5/c1-5-9-11-13-15-24-19(22-7-3)17-21-18-20(23-8-4)25-16-14-12-10-6-2/h19-20H,5-18H2,1-4H3
InChIKey
KDSIQFJJVKRHLW-UHFFFAOYSA-N
Compound name
1-[1-ethoxy-2-(2-ethoxy-2-hexoxyethoxy)ethoxy]hexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.30322 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.31050 194.0
[M+Na]+ 385.29244 199.7
[M+NH4]+ 380.33704 211.8
[M+K]+ 401.26638 193.8
[M-H]- 361.29594 191.0
[M+Na-2H]- 383.27789 192.6
[M]+ 362.30267 193.5
[M]- 362.30377 193.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.