CID 3057046

Plumbane, adipoyltributyl-

Structural Information

Molecular Formula
C30H62O2Pb2
SMILES
CCCC[Pb](CCCC)(CCCC)C(=O)CCCCC(=O)[Pb](CCCC)(CCCC)CCCC
InChI
InChI=1S/C6H8O2.6C4H9.2Pb/c7-5-3-1-2-4-6-8;6*1-3-4-2;;/h1-4H2;6*1,3-4H2,2H3;;
InChIKey
NLDFIIBPOIQHDX-UHFFFAOYSA-N
Compound name
1,6-bis(tributylplumbyl)hexane-1,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

870.4283 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 871.43558 313.1
[M+Na]+ 893.41752 321.3
[M-H]- 869.42102 302.3
[M+NH4]+ 888.46212 318.5
[M+K]+ 909.39146 324.4
[M+H-H2O]+ 853.42556 308.7
[M+HCOO]- 915.42650 320.6
[M+CH3COO]- 929.44215 263.7
[M+Na-2H]- 891.40297 292.7
[M]+ 870.42775 307.1
[M]- 870.42885 307.1
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.