CID 16684122

Dibutyltin diisostearate

Structural Information

Molecular Formula
C44H88O4Sn
SMILES
CCCC[Sn](CCCC)(OC(=O)CCCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCC(C)C
InChI
InChI=1S/2C18H36O2.2C4H9.Sn/c2*1-17(2)15-13-11-9-7-5-3-4-6-8-10-12-14-16-18(19)20;2*1-3-4-2;/h2*17H,3-16H2,1-2H3,(H,19,20);2*1,3-4H2,2H3;/q;;;;+2/p-2
InChIKey
ZPLRFSGMNSYWCH-UHFFFAOYSA-L
Compound name
[dibutyl(16-methylheptadecanoyloxy)stannyl] 16-methylheptadecanoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

13
Patents

800.57043 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 801.57771 287.1
[M+Na]+ 823.55965 287.2
[M+NH4]+ 818.60425 289.6
[M+K]+ 839.53359 288.0
[M-H]- 799.56315 270.4
[M+Na-2H]- 821.54510 283.5
[M]+ 800.56988 283.1
[M]- 800.57098 283.1
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