CID 105880

67874-46-8

Structural Information

Molecular Formula
C16H30O6S3Sn
SMILES
CCC(=O)OCCS[Sn](C)(SCCOC(=O)CC)SCCOC(=O)CC
InChI
InChI=1S/3C5H10O2S.CH3.Sn/c3*1-2-5(6)7-3-4-8;;/h3*8H,2-4H2,1H3;1H3;/q;;;;+3/p-3
InChIKey
HYXYGXCZBAZPBH-UHFFFAOYSA-K
Compound name
2-[methyl-bis(2-propanoyloxyethylsulfanyl)stannyl]sulfanylethyl propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

534.02264 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 535.02992 213.9
[M+Na]+ 557.01186 216.0
[M+NH4]+ 552.05646 216.6
[M+K]+ 572.98580 207.4
[M-H]- 533.01536 209.1
[M+Na-2H]- 554.99731 209.1
[M]+ 534.02209 213.7
[M]- 534.02319 213.7
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.