CID 16683030

2,2-dibutyl-1,3,2-oxathiastannolane

Structural Information

Molecular Formula
C10H22OSSn
SMILES
CCCC[Sn]1(OCCS1)CCCC
InChI
InChI=1S/2C4H9.C2H5OS.Sn/c2*1-3-4-2;3-1-2-4;/h2*1,3-4H2,2H3;4H,1-2H2;/q;;-1;+2/p-1
InChIKey
TWNAELGEYKMPLY-UHFFFAOYSA-M
Compound name
2,2-dibutyl-1,3,2-oxathiastannolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

310.04135 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.04863 167.4
[M+Na]+ 333.03057 172.2
[M-H]- 309.03407 170.0
[M+NH4]+ 328.07517 188.5
[M+K]+ 349.00451 170.9
[M+H-H2O]+ 293.03861 161.7
[M+HCOO]- 355.03955 182.2
[M+CH3COO]- 369.05520 187.7
[M+Na-2H]- 331.01602 167.2
[M]+ 310.04080 170.5
[M]- 310.04190 170.5
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

No patent data available for this compound.