CID 16684849

Tin, dibromobis(2,4-pentanedionato-kappao2,kappao4)-

Structural Information

Molecular Formula
C10H14Br2O4Sn
SMILES
CC(=CC(=O)C)O[Sn](OC(=CC(=O)C)C)(Br)Br
InChI
InChI=1S/2C5H8O2.2BrH.Sn/c2*1-4(6)3-5(2)7;;;/h2*3,6H,1-2H3;2*1H;/q;;;;+4/p-4
InChIKey
KVKLTXKAUBLTRX-UHFFFAOYSA-J
Compound name
4-[dibromo(4-oxopent-2-en-2-yloxy)stannyl]oxypent-3-en-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

475.8281 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 476.83538 178.0
[M+Na]+ 498.81732 185.9
[M-H]- 474.82082 180.8
[M+NH4]+ 493.86192 193.5
[M+K]+ 514.79126 169.9
[M+H-H2O]+ 458.82536 184.1
[M+HCOO]- 520.82630 188.4
[M+CH3COO]- 534.84195 216.1
[M+Na-2H]- 496.80277 178.2
[M]+ 475.82755 213.2
[M]- 475.82865 213.2
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.