CID 4162575

5,8,11,14,17,20-hexaoxatetracosane

Structural Information

Molecular Formula
C18H38O6
SMILES
CCCCOCCOCCOCCOCCOCCOCCCC
InChI
InChI=1S/C18H38O6/c1-3-5-7-19-9-11-21-13-15-23-17-18-24-16-14-22-12-10-20-8-6-4-2/h3-18H2,1-2H3
InChIKey
XKSDUDXHYJJQDM-UHFFFAOYSA-N
Compound name
1-[2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]butane
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

0
References

73
Patents

350.26685 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.27413 189.0
[M+Na]+ 373.25607 190.8
[M-H]- 349.25957 186.7
[M+NH4]+ 368.30067 202.0
[M+K]+ 389.23001 190.5
[M+H-H2O]+ 333.26411 181.0
[M+HCOO]- 395.26505 210.2
[M+CH3COO]- 409.28070 214.7
[M+Na-2H]- 371.24152 190.0
[M]+ 350.26630 203.6
[M]- 350.26740 203.6
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

patents stripe