CID 6455520

67669-59-4

Structural Information

Molecular Formula
C32H58O8
SMILES
CCCCCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOCCOCCOCCO
InChI
InChI=1S/C32H58O8/c1-2-3-4-5-6-7-8-9-10-11-12-31-13-15-32(16-14-31)40-30-29-39-28-27-38-26-25-37-24-23-36-22-21-35-20-19-34-18-17-33/h13-16,33H,2-12,17-30H2,1H3
InChIKey
DBYCHBRPJCNLSN-UHFFFAOYSA-N
Compound name
2-[2-[2-[2-[2-[2-[2-(4-dodecylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

570.41315 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 571.42043 236.1
[M+Na]+ 593.40237 239.5
[M-H]- 569.40587 220.9
[M+NH4]+ 588.44697 235.6
[M+K]+ 609.37631 239.2
[M+H-H2O]+ 553.41041 234.0
[M+HCOO]- 615.41135 251.0
[M+CH3COO]- 629.42700 252.7
[M+Na-2H]- 591.38782 241.6
[M]+ 570.41260 236.4
[M]- 570.41370 236.4
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.