CID 97086

Dineophyl tin oxide

Structural Information

Molecular Formula

C₂₀H₂₆OSn

SMILES

CC(C)(C[Sn](=O)CC(C)(C)C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/2C10H13.O.Sn/c2*1-10(2,3)9-7-5-4-6-8-9;;/h2*4-8H,1H2,2-3H3;;

InChIKey

KKMCHPIGCYMHAX-UHFFFAOYSA-N

Compound name

bis(2-methyl-2-phenylpropyl)-oxotin

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 402.10056 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]+	403.10784	193.8
[M+Na]+	425.08978	197.4
[M-H]-	401.09328	198.7
[M+NH4]+	420.13438	207.6
[M+K]+	441.06372	192.7
[M+H-H2O]+	385.09782	185.2
[M+HCOO]-	447.09876	210.8
[M+CH3COO]-	461.11441	209.9
[M+Na-2H]-	423.07523	196.3
[M]+	402.10001	194.5
[M]-	402.10111	194.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe