CID 16682741

Tributyltin acetate

Structural Information

Molecular Formula
C14H30O2Sn
SMILES
CCCC[Sn](CCCC)(CCCC)OC(=O)C
InChI
InChI=1S/3C4H9.C2H4O2.Sn/c3*1-3-4-2;1-2(3)4;/h3*1,3-4H2,2H3;1H3,(H,3,4);/q;;;;+1/p-1
InChIKey
PWBHRVGYSMBMIO-UHFFFAOYSA-M
Compound name
tributylstannyl acetate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1532
References

4735
Patents

350.12677 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.13405 186.4
[M+Na]+ 373.11599 189.7
[M-H]- 349.11949 184.6
[M+NH4]+ 368.16059 203.2
[M+K]+ 389.08993 187.7
[M+H-H2O]+ 333.12403 179.9
[M+HCOO]- 395.12497 204.2
[M+CH3COO]- 409.14062 202.0
[M+Na-2H]- 371.10144 186.0
[M]+ 350.12622 192.3
[M]- 350.12732 192.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe