CID 16684355

Tributyltin nonanoate

Structural Information

Molecular Formula
C21H44O2Sn
SMILES
CCCCCCCCC(=O)O[Sn](CCCC)(CCCC)CCCC
InChI
InChI=1S/C9H18O2.3C4H9.Sn/c1-2-3-4-5-6-7-8-9(10)11;3*1-3-4-2;/h2-8H2,1H3,(H,10,11);3*1,3-4H2,2H3;/q;;;;+1/p-1
InChIKey
WHQOTKWKDQHRMA-UHFFFAOYSA-M
Compound name
tributylstannyl nonanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

448.23633 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 449.24361 209.9
[M+Na]+ 471.22555 216.2
[M+NH4]+ 466.27015 214.3
[M+K]+ 487.19949 207.6
[M-H]- 447.22905 207.4
[M+Na-2H]- 469.21100 208.2
[M]+ 448.23578 209.8
[M]- 448.23688 209.8
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