CID 16684521

84029-40-3

Structural Information

Molecular Formula
C21H34O4Sn
SMILES
CCCC[Sn](CCCC)(CCCC)OC(=O)C1=CC=CC=C1OC(=O)C
InChI
InChI=1S/C9H8O4.3C4H9.Sn/c1-6(10)13-8-5-3-2-4-7(8)9(11)12;3*1-3-4-2;/h2-5H,1H3,(H,11,12);3*1,3-4H2,2H3;/q;;;;+1/p-1
InChIKey
ZUWWEGWEUMHGLQ-UHFFFAOYSA-M
Compound name
tributylstannyl 2-acetyloxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

470.14792 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 471.15520 208.1
[M+Na]+ 493.13714 216.5
[M+NH4]+ 488.18174 212.3
[M+K]+ 509.11108 209.6
[M-H]- 469.14064 207.2
[M+Na-2H]- 491.12259 209.3
[M]+ 470.14737 208.8
[M]- 470.14847 208.8
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