CID 16683784

Diacetoxydiphenylplumbane

Structural Information

Molecular Formula
C16H16O4Pb
SMILES
CC(=O)O[Pb](C1=CC=CC=C1)(C2=CC=CC=C2)OC(=O)C
InChI
InChI=1S/2C6H5.2C2H4O2.Pb/c2*1-2-4-6-5-3-1;2*1-2(3)4;/h2*1-5H;2*1H3,(H,3,4);/q;;;;+2/p-2
InChIKey
SBXMABAVUXVYFZ-UHFFFAOYSA-L
Compound name
[acetyloxy(diphenyl)plumbyl] acetate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3
Patents

480.0815 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 481.08878 203.5
[M+Na]+ 503.07072 207.4
[M-H]- 479.07422 208.3
[M+NH4]+ 498.11532 216.3
[M+K]+ 519.04466 204.5
[M+H-H2O]+ 463.07876 193.7
[M+HCOO]- 525.07970 222.3
[M+CH3COO]- 539.09535 206.0
[M+Na-2H]- 501.05617 204.3
[M]+ 480.08095 206.0
[M]- 480.08205 206.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe