CID 10533055

171290-94-1

Structural Information

Molecular Formula
C32H58S2Sn2
SMILES
CCCC[Sn](CCCC)(CCCC)C1=CC=C(S1)C2=CC=C(S2)[Sn](CCCC)(CCCC)CCCC
InChI
InChI=1S/C8H4S2.6C4H9.2Sn/c1-3-7(9-5-1)8-4-2-6-10-8;6*1-3-4-2;;/h1-4H;6*1,3-4H2,2H3;;
InChIKey
HCHJCBXNKUSQOT-UHFFFAOYSA-N
Compound name
tributyl-[5-(5-tributylstannylthiophen-2-yl)thiophen-2-yl]stannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

137
Patents

746.2024 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 747.20968 281.2
[M+Na]+ 769.19162 281.9
[M-H]- 745.19512 283.8
[M+NH4]+ 764.23622 290.2
[M+K]+ 785.16556 272.3
[M+H-H2O]+ 729.19966 271.3
[M+HCOO]- 791.20060 286.4
[M+CH3COO]- 805.21625 258.0
[M+Na-2H]- 767.17707 267.8
[M]+ 746.20185 293.2
[M]- 746.20295 293.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe