CID 81803

7346-78-3

Structural Information

Molecular Formula
C24H46O6
SMILES
CCCCCCCCCC(=O)OCCOCCOCCOC(=O)CCCCCCC
InChI
InChI=1S/C24H46O6/c1-3-5-7-9-10-12-14-16-24(26)30-22-20-28-18-17-27-19-21-29-23(25)15-13-11-8-6-4-2/h3-22H2,1-2H3
InChIKey
RCGZRZBMXNWTFH-UHFFFAOYSA-N
Compound name
2-[2-(2-octanoyloxyethoxy)ethoxy]ethyl decanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

260
Patents

430.32944 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 431.33672 212.0
[M+Na]+ 453.31866 223.0
[M+NH4]+ 448.36326 223.6
[M+K]+ 469.29260 221.2
[M-H]- 429.32216 210.2
[M+Na-2H]- 451.30411 208.9
[M]+ 430.32889 218.9
[M]- 430.32999 218.9
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