CID 87258

Stauffer r-7240

Structural Information

Molecular Formula
C6H10NO4PS3
SMILES
COP(=S)(OC)SCN1C(=O)CSC1=O
InChI
InChI=1S/C6H10NO4PS3/c1-10-12(13,11-2)15-4-7-5(8)3-14-6(7)9/h3-4H2,1-2H3
InChIKey
AVRCLFGJSYYCDL-UHFFFAOYSA-N
Compound name
3-(dimethoxyphosphinothioylsulfanylmethyl)-1,3-thiazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.95096 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.95824 156.9
[M+Na]+ 309.94018 162.8
[M+NH4]+ 304.98478 162.9
[M+K]+ 325.91412 156.4
[M-H]- 285.94368 155.1
[M+Na-2H]- 307.92563 155.9
[M]+ 286.95041 158.1
[M]- 286.95151 158.1
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.