CID 9576300

67874-47-9

Structural Information

Molecular Formula
C16H32O4S2Sn
SMILES
CCCC[Sn](CCCC)(SCCOC(=O)C)SCCOC(=O)C
InChI
InChI=1S/2C4H8O2S.2C4H9.Sn/c2*1-4(5)6-2-3-7;2*1-3-4-2;/h2*7H,2-3H2,1H3;2*1,3-4H2,2H3;/q;;;;+2/p-2
InChIKey
XCXPJDWGCJETNF-UHFFFAOYSA-L
Compound name
2-[2-acetyloxyethylsulfanyl(dibutyl)stannyl]sulfanylethyl acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

472.07642 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 473.08370 209.9
[M+Na]+ 495.06564 211.1
[M-H]- 471.06914 207.1
[M+NH4]+ 490.11024 221.7
[M+K]+ 511.03958 206.8
[M+H-H2O]+ 455.07368 201.7
[M+HCOO]- 517.07462 215.5
[M+CH3COO]- 531.09027 218.4
[M+Na-2H]- 493.05109 203.5
[M]+ 472.07587 220.1
[M]- 472.07697 220.1
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

No patent data available for this compound.