CID 3032732

Tributyltin

Structural Information

Molecular Formula

C₁₂H₂₇Sn

SMILES

CCCC[Sn](CCCC)CCCC

InChI

InChI=1S/3C4H9.Sn/c3*1-3-4-2;/h3*1,3-4H2,2H3;

InChIKey

PIILXFBHQILWPS-UHFFFAOYSA-N

Compound name

None

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 1532
References: 28912
Patents: 291.11346 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]+	292.12074	172.4
[M+Na]+	314.10268	175.7
[M-H]-	290.10618	170.7
[M+NH4]+	309.14728	191.5
[M+K]+	330.07662	173.6
[M+H-H2O]+	274.11072	165.9
[M+HCOO]-	336.11166	191.7
[M+CH3COO]-	350.12731	193.5
[M+Na-2H]-	312.08813	172.3
[M]+	291.11291	175.8
[M]-	291.11401	175.8

Literature stripe

literature stripe

Patent stripe

patents stripe