CID 164511717

Ns00086632

Structural Information

Molecular Formula
C48H102O6P3S6Sb
SMILES
CCCCC(CC)COP(=S)(OCC(CC)CCCC)S[Sb](SP(=S)(OCC(CC)CCCC)OCC(CC)CCCC)SP(=S)(OCC(CC)CCCC)OCC(CC)CCCC
InChI
InChI=1S/3C16H35O2PS2.Sb/c3*1-5-9-11-15(7-3)13-17-19(20,21)18-14-16(8-4)12-10-6-2;/h3*15-16H,5-14H2,1-4H3,(H,20,21);/q;;;+3/p-3
InChIKey
HWFCBJDGOMEJGH-UHFFFAOYSA-K
Compound name
bis[bis(2-ethylhexoxy)phosphinothioylsulfanyl]stibanylsulfanyl-bis(2-ethylhexoxy)-sulfanylidene-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

1180.4252 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 1181.432476 346.5
[M+Na]+ 1203.414418 336.8
[M-H]- 1179.417924 324.5
[M+NH4]+ 1198.459023 354.3
[M+K]+ 1219.388358 352.4
[M+H-H2O]+ 1163.422460 327.0
[M+HCOO]- 1225.423401 334.1
[M+CH3COO]- 1239.439051 319.1
[M+Na-2H]- 1201.399866 320.2
[M]+ 1180.42465142 353.6
[M]- 1180.42574858 353.6
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.