CID 85041

Butyltris(dodecylthio)stannane

Structural Information

Molecular Formula
C40H84S3Sn
SMILES
CCCCCCCCCCCCS[Sn](CCCC)(SCCCCCCCCCCCC)SCCCCCCCCCCCC
InChI
InChI=1S/3C12H26S.C4H9.Sn/c3*1-2-3-4-5-6-7-8-9-10-11-12-13;1-3-4-2;/h3*13H,2-12H2,1H3;1,3-4H2,2H3;/q;;;;+3/p-3
InChIKey
BXTPXLVVVVHPKJ-UHFFFAOYSA-K
Compound name
butyl-tris(dodecylsulfanyl)stannane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

9
Patents

780.4757 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 781.48298 319.5
[M+Na]+ 803.46492 317.3
[M-H]- 779.46842 287.5
[M+NH4]+ 798.50952 313.2
[M+K]+ 819.43886 325.6
[M+H-H2O]+ 763.47296 313.7
[M+HCOO]- 825.47390 321.6
[M+CH3COO]- 839.48955 281.5
[M+Na-2H]- 801.45037 294.3
[M]+ 780.47515 321.8
[M]- 780.47625 321.8
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