CID 16695701

Tributyltin maleate

Structural Information

Molecular Formula
C16H30O4Sn
SMILES
CCCC[Sn](CCCC)(CCCC)OC(=O)/C=C\C(=O)O
InChI
InChI=1S/C4H4O4.3C4H9.Sn/c5-3(6)1-2-4(7)8;3*1-3-4-2;/h1-2H,(H,5,6)(H,7,8);3*1,3-4H2,2H3;/q;;;;+1/p-1/b2-1-;;;;
InChIKey
OWPROSQENMJLFR-SQDRRJMKSA-M
Compound name
(Z)-4-oxo-4-tributylstannyloxybut-2-enoic acid
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

0
Patents

406.1166 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.12388 198.4
[M+Na]+ 429.10582 200.7
[M-H]- 405.10932 194.9
[M+NH4]+ 424.15042 211.9
[M+K]+ 445.07976 197.6
[M+H-H2O]+ 389.11386 191.6
[M+HCOO]- 451.11480 213.9
[M+CH3COO]- 465.13045 207.5
[M+Na-2H]- 427.09127 195.5
[M]+ 406.11605 203.8
[M]- 406.11715 203.8
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.