CID 109089

Butyl 3-(trichlorostannyl)propionate

Structural Information

Molecular Formula
C7H13Cl3O2Sn
SMILES
CCCCOC(=O)CC[Sn](Cl)(Cl)Cl
InChI
InChI=1S/C7H13O2.3ClH.Sn/c1-3-5-6-9-7(8)4-2;;;;/h2-6H2,1H3;3*1H;/q;;;;+3/p-3
InChIKey
KKIZJTLMVRCRAA-UHFFFAOYSA-K
Compound name
butyl 3-trichlorostannylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

353.90033 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.90761 164.9
[M+Na]+ 376.88955 175.5
[M+NH4]+ 371.93415 171.8
[M+K]+ 392.86349 168.3
[M-H]- 352.89305 162.7
[M+Na-2H]- 374.87500 166.9
[M]+ 353.89978 166.5
[M]- 353.90088 166.5
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