CID 16683123

(benzoyloxy)(diphenyl)bismuthine

Structural Information

Molecular Formula
C19H15BiO2
SMILES
C1=CC=C(C=C1)C(=O)O[Bi](C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C7H6O2.2C6H5.Bi/c8-7(9)6-4-2-1-3-5-6;2*1-2-4-6-5-3-1;/h1-5H,(H,8,9);2*1-5H;/q;;;+1/p-1
InChIKey
YGPQHTCSQNCBBO-UHFFFAOYSA-M
Compound name
diphenylbismuthanyl benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

484.0876 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 485.09488 205.8
[M+Na]+ 507.07682 208.9
[M-H]- 483.08032 213.0
[M+NH4]+ 502.12142 217.6
[M+K]+ 523.05076 203.4
[M+H-H2O]+ 467.08486 194.3
[M+HCOO]- 529.08580 225.5
[M+CH3COO]- 543.10145 208.1
[M+Na-2H]- 505.06227 206.3
[M]+ 484.08705 204.6
[M]- 484.08815 204.6
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.