CID 138395839

Tin, dibutylbis(2,4-pentanedionato-.kappa.o2,.kappa.o4)-, (oc-6-11)-

Structural Information

Molecular Formula
C18H32O4Sn
SMILES
CCCC[Sn](O/C(=C\C(=O)C)/C)(O/C(=C\C(=O)C)/C)CCCC
InChI
InChI=1S/2C5H8O2.2C4H9.Sn/c2*1-4(6)3-5(2)7;2*1-3-4-2;/h2*3,6H,1-2H3;2*1,3-4H2,2H3;/q;;;;+2/p-2/b2*4-3-;;;
InChIKey
UVDDHYAAWVNATK-VGKOASNMSA-L
Compound name
(Z)-4-[dibutyl-[(Z)-4-oxopent-2-en-2-yl]oxystannyl]oxypent-3-en-2-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

432.13226 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 433.139536 204.0
[M+Na]+ 455.121478 205.9
[M-H]- 431.124984 201.8
[M+NH4]+ 450.166083 215.4
[M+K]+ 471.095418 203.6
[M+H-H2O]+ 415.129520 197.1
[M+HCOO]- 477.130461 217.1
[M+CH3COO]- 491.146111 216.7
[M+Na-2H]- 453.106926 198.5
[M]+ 432.13171142 210.2
[M]- 432.13280858 210.2
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.