CID 163360618

38873-39-1

Structural Information

Molecular Formula
C14H16As2O6Pb
SMILES
CO[As](=O)O[Pb](C1=CC=CC=C1)(C2=CC=CC=C2)O[As](=O)OC
InChI
InChI=1S/2C6H5.2CH4AsO3.Pb/c2*1-2-4-6-5-3-1;2*1-5-2(3)4;/h2*1-5H;2*1H3,(H,3,4);/q;;;;+2/p-2
InChIKey
YWBHDMUVPYKGPZ-UHFFFAOYSA-L
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

637.91455 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 638.92183 231.4
[M+Na]+ 660.90377 233.6
[M-H]- 636.90727 234.9
[M+NH4]+ 655.94837 241.0
[M+K]+ 676.87771 231.5
[M+H-H2O]+ 620.91181 219.6
[M+HCOO]- 682.91275 249.0
[M+CH3COO]- 696.92840 215.8
[M+Na-2H]- 658.88922 230.1
[M]+ 637.91400 236.7
[M]- 637.91510 236.7
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.