CID 9576571

68928-49-4

Structural Information

Molecular Formula
C38H76O4S2Sn
SMILES
CCCCCCCCCCCCCCCC(=O)OCCS[Sn](C)(C)SCCOC(=O)CCCCCCCCCCCCCCC
InChI
InChI=1S/2C18H36O2S.2CH3.Sn/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(19)20-16-17-21;;;/h2*21H,2-17H2,1H3;2*1H3;/q;;;;+2/p-2
InChIKey
NBSFHVIPHKQBSK-UHFFFAOYSA-L
Compound name
2-[2-hexadecanoyloxyethylsulfanyl(dimethyl)stannyl]sulfanylethyl hexadecanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

780.4207 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 781.42798 290.6
[M+Na]+ 803.40992 295.8
[M+NH4]+ 798.45452 292.3
[M+K]+ 819.38386 290.9
[M-H]- 779.41342 273.0
[M+Na-2H]- 801.39537 287.3
[M]+ 780.42015 287.2
[M]- 780.42125 287.2
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.