CID 16683951

Dimethyltin thioglycolate

Structural Information

Molecular Formula
C4H8O2SSn
SMILES
C[Sn]1(OC(=O)CS1)C
InChI
InChI=1S/C2H4O2S.2CH3.Sn/c3-2(4)1-5;;;/h5H,1H2,(H,3,4);2*1H3;/q;;;+2/p-2
InChIKey
XIDZPWZINDODBR-UHFFFAOYSA-L
Compound name
2,2-dimethyl-1,3,2-oxathiastannolan-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

239.9267 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.933976 142.0
[M+Na]+ 262.915918 150.5
[M-H]- 238.919424 146.2
[M+NH4]+ 257.960523 166.1
[M+K]+ 278.889858 150.5
[M+H-H2O]+ 222.923960 137.8
[M+HCOO]- 284.924901 159.2
[M+CH3COO]- 298.940551 171.8
[M+Na-2H]- 260.901366 144.5
[M]+ 239.92615142 144.1
[M]- 239.92724858 144.1
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

patents stripe