CID 16682764

Dibutylbis((1-oxoisodecyl)oxy)stannane

Structural Information

Molecular Formula
C28H56O4Sn
SMILES
CCCC[Sn](CCCC)(OC(=O)CCCCCCC(C)C)OC(=O)CCCCCCC(C)C
InChI
InChI=1S/2C10H20O2.2C4H9.Sn/c2*1-9(2)7-5-3-4-6-8-10(11)12;2*1-3-4-2;/h2*9H,3-8H2,1-2H3,(H,11,12);2*1,3-4H2,2H3;/q;;;;+2/p-2
InChIKey
XKILITIYNKWIPW-UHFFFAOYSA-L
Compound name
[dibutyl(8-methylnonanoyloxy)stannyl] 8-methylnonanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

576.32007 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 577.32735 247.9
[M+Na]+ 599.30929 256.0
[M-H]- 575.31279 240.4
[M+NH4]+ 594.35389 255.3
[M+K]+ 615.28323 256.8
[M+H-H2O]+ 559.31733 248.4
[M+HCOO]- 621.31827 252.5
[M+CH3COO]- 635.33392 247.3
[M+Na-2H]- 597.29474 234.9
[M]+ 576.31952 248.1
[M]- 576.32062 248.1
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