CID 16684522

84051-94-5

Structural Information

Molecular Formula
C15H34N2O3Sn
SMILES
CCCC[Sn](CCCC)(OCC(C)NCCN)OC(=O)C
InChI
InChI=1S/C5H13N2O.2C4H9.C2H4O2.Sn/c1-5(4-8)7-3-2-6;2*1-3-4-2;1-2(3)4;/h5,7H,2-4,6H2,1H3;2*1,3-4H2,2H3;1H3,(H,3,4);/q-1;;;;+2/p-1
InChIKey
ASSRYCKRDFVJIF-UHFFFAOYSA-M
Compound name
[2-(2-aminoethylamino)propoxy-dibutylstannyl] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

410.15915 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 411.166426 201.4
[M+Na]+ 433.148368 202.0
[M-H]- 409.151874 198.6
[M+NH4]+ 428.192973 214.5
[M+K]+ 449.122308 200.6
[M+H-H2O]+ 393.156410 193.3
[M+HCOO]- 455.157351 219.4
[M+CH3COO]- 469.173001 217.0
[M+Na-2H]- 431.133816 198.8
[M]+ 410.15860142 205.5
[M]- 410.15969858 205.5
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

No patent data available for this compound.