CID 9576569

68928-47-2

Structural Information

Molecular Formula
C32H64O4S2Sn
SMILES
CCCCCCCCCC(=O)OCCS[Sn](CCCC)(CCCC)SCCOC(=O)CCCCCCCCC
InChI
InChI=1S/2C12H24O2S.2C4H9.Sn/c2*1-2-3-4-5-6-7-8-9-12(13)14-10-11-15;2*1-3-4-2;/h2*15H,2-11H2,1H3;2*1,3-4H2,2H3;/q;;;;+2/p-2
InChIKey
HTVFLQXFALLVTP-UHFFFAOYSA-L
Compound name
2-[dibutyl(2-decanoyloxyethylsulfanyl)stannyl]sulfanylethyl decanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

696.3268 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 697.33408 271.4
[M+Na]+ 719.31602 277.2
[M+NH4]+ 714.36062 273.4
[M+K]+ 735.28996 271.3
[M-H]- 695.31952 255.8
[M+Na-2H]- 717.30147 270.1
[M]+ 696.32625 268.5
[M]- 696.32735 268.5
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.