CID 9576568

Dimethyltinbis(2-dodecanoyloxyethylmercaptide)

Structural Information

Molecular Formula
C30H60O4S2Sn
SMILES
CCCCCCCCCCCC(=O)OCCS[Sn](C)(C)SCCOC(=O)CCCCCCCCCCC
InChI
InChI=1S/2C14H28O2S.2CH3.Sn/c2*1-2-3-4-5-6-7-8-9-10-11-14(15)16-12-13-17;;;/h2*17H,2-13H2,1H3;2*1H3;/q;;;;+2/p-2
InChIKey
OYEBHCPLESCPFZ-UHFFFAOYSA-L
Compound name
2-[2-dodecanoyloxyethylsulfanyl(dimethyl)stannyl]sulfanylethyl dodecanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

668.29553 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 669.30281 280.4
[M+Na]+ 691.28475 282.4
[M-H]- 667.28825 261.8
[M+NH4]+ 686.32935 282.0
[M+K]+ 707.25869 285.4
[M+H-H2O]+ 651.29279 278.1
[M+HCOO]- 713.29373 285.2
[M+CH3COO]- 727.30938 257.6
[M+Na-2H]- 689.27020 261.0
[M]+ 668.29498 282.1
[M]- 668.29608 282.1
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