CID 16682797

Thiophenyl triphenyllead

Structural Information

Molecular Formula
C24H20PbS
SMILES
C1=CC=C(C=C1)S[Pb](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C6H6S.3C6H5.Pb/c7-6-4-2-1-3-5-6;3*1-2-4-6-5-3-1;/h1-5,7H;3*1-5H;/q;;;;+1/p-1
InChIKey
BQBUWUDGISVYKZ-UHFFFAOYSA-M
Compound name
triphenyl(phenylsulfanyl)plumbane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

7
Patents

548.1052 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 549.11248 220.9
[M+Na]+ 571.09442 224.9
[M-H]- 547.09792 230.6
[M+NH4]+ 566.13902 230.7
[M+K]+ 587.06836 215.9
[M+H-H2O]+ 531.10246 208.8
[M+HCOO]- 593.10340 235.4
[M+CH3COO]- 607.11905 227.6
[M+Na-2H]- 569.07987 221.8
[M]+ 548.10465 219.4
[M]- 548.10575 219.4
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