CID 71300512

(isodecanoato-o)(isononanoato-o)lead

Structural Information

Molecular Formula
C19H36O4Pb
SMILES
CC(C)CCCCCCC(=O)O[Pb]OC(=O)CCCCCC(C)C
InChI
InChI=1S/C10H20O2.C9H18O2.Pb/c1-9(2)7-5-3-4-6-8-10(11)12;1-8(2)6-4-3-5-7-9(10)11;/h9H,3-8H2,1-2H3,(H,11,12);8H,3-7H2,1-2H3,(H,10,11);/q;;+2/p-2
InChIKey
IQGOEFHMELKBAL-UHFFFAOYSA-L
Compound name
8-methylnonanoyloxy(7-methyloctanoyloxy)lead
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

536.23804 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 537.24532 232.3
[M+Na]+ 559.22726 232.0
[M-H]- 535.23076 228.8
[M+NH4]+ 554.27186 245.7
[M+K]+ 575.20120 229.6
[M+H-H2O]+ 519.23530 223.3
[M+HCOO]- 581.23624 245.9
[M+CH3COO]- 595.25189 224.6
[M+Na-2H]- 557.21271 223.0
[M]+ 536.23749 240.8
[M]- 536.23859 240.8
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.