CID 71300518

Einecs 304-166-8

Structural Information

Molecular Formula
C18H34O4Pb
SMILES
CCCCC(CC)C(=O)O[Pb]OC(=O)CCCCCCC(C)C
InChI
InChI=1S/C10H20O2.C8H16O2.Pb/c1-9(2)7-5-3-4-6-8-10(11)12;1-3-5-6-7(4-2)8(9)10;/h9H,3-8H2,1-2H3,(H,11,12);7H,3-6H2,1-2H3,(H,9,10);/q;;+2/p-2
InChIKey
HXRFYASIPIRYLI-UHFFFAOYSA-L
Compound name
2-ethylhexanoyloxy(8-methylnonanoyloxy)lead
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

522.22235 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 523.22963 214.8
[M+Na]+ 545.21157 219.7
[M+NH4]+ 540.25617 211.0
[M+K]+ 561.18551 213.4
[M-H]- 521.21507 211.0
[M+Na-2H]- 543.19702 210.9
[M]+ 522.22180 213.8
[M]- 522.22290 213.8
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

No patent data available for this compound.