CID 15630343

Anthiolimine

Structural Information

Molecular Formula
C12H15O12S3Sb
SMILES
C(C(C(=O)O)S[Sb](SC(CC(=O)O)C(=O)O)SC(CC(=O)O)C(=O)O)C(=O)O
InChI
InChI=1S/3C4H6O4S.Sb/c3*5-3(6)1-2(9)4(7)8;/h3*2,9H,1H2,(H,5,6)(H,7,8);/q;;;+3/p-3
InChIKey
RIQPOGDQSKYVFD-UHFFFAOYSA-K
Compound name
2-[bis(1,2-dicarboxyethylsulfanyl)stibanylsulfanyl]butanedioic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

23
References

136
Patents

567.8764 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 568.88368 222.1
[M+Na]+ 590.86562 230.8
[M+NH4]+ 585.91022 229.8
[M+K]+ 606.83956 224.5
[M-H]- 566.86912 227.9
[M+Na-2H]- 588.85107 230.1
[M]+ 567.87585 225.4
[M]- 567.87695 225.4
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.