CID 16684534

Dioctylbis(palmitoyloxy)stannane

Structural Information

Molecular Formula
C48H96O4Sn
SMILES
CCCCCCCCCCCCCCCC(=O)O[Sn](CCCCCCCC)(CCCCCCCC)OC(=O)CCCCCCCCCCCCCCC
InChI
InChI=1S/2C16H32O2.2C8H17.Sn/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18;2*1-3-5-7-8-6-4-2;/h2*2-15H2,1H3,(H,17,18);2*1,3-8H2,2H3;/q;;;;+2/p-2
InChIKey
HUYAMDVOPBKCJF-UHFFFAOYSA-L
Compound name
[hexadecanoyloxy(dioctyl)stannyl] hexadecanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

856.63306 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 857.64034 298.3
[M+Na]+ 879.62228 298.1
[M+NH4]+ 874.66688 299.0
[M+K]+ 895.59622 299.7
[M-H]- 855.62578 277.9
[M+Na-2H]- 877.60773 292.9
[M]+ 856.63251 293.2
[M]- 856.63361 293.2
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