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

1
Patents

406.1166 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.123876 198.4
[M+Na]+ 429.105818 200.7
[M-H]- 405.109324 194.9
[M+NH4]+ 424.150423 211.9
[M+K]+ 445.079758 197.6
[M+H-H2O]+ 389.113860 191.6
[M+HCOO]- 451.114801 213.9
[M+CH3COO]- 465.130451 207.5
[M+Na-2H]- 427.091266 195.5
[M]+ 406.11605142 203.8
[M]- 406.11714858 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

patents stripe