CID 116008

Diisopentyltin oxide

Structural Information

Molecular Formula

C₁₀H₂₂OSn

SMILES

CC(C)CC[Sn](=O)CCC(C)C

InChI

InChI=1S/2C5H11.O.Sn/c2*1-4-5(2)3;;/h2*5H,1,4H2,2-3H3;;

InChIKey

FDAGGJUMCHPKNY-UHFFFAOYSA-N

Compound name

bis(3-methylbutyl)-oxotin

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 25
Patents: 278.06927 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	279.07655	159.4
[M+Na]+	301.05849	168.0
[M+NH4]+	296.10309	166.3
[M+K]+	317.03243	161.9
[M-H]-	277.06199	158.3
[M+Na-2H]-	299.04394	160.4
[M]+	278.06872	160.0
[M]-	278.06982	160.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe