CID 16683963

Bismuthine, (benzoyloxy)oxo-

Structural Information

Molecular Formula
C7H5BiO3
SMILES
C1=CC=C(C=C1)C(=O)O[Bi]=O
InChI
InChI=1S/C7H6O2.Bi.O/c8-7(9)6-4-2-1-3-5-6;;/h1-5H,(H,8,9);;/q;+1;/p-1
InChIKey
DELQWXXYVBRYIG-UHFFFAOYSA-M
Compound name
oxobismuthanyl benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

346.00427 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.01155 158.6
[M+Na]+ 368.99349 170.3
[M+NH4]+ 364.03809 165.8
[M+K]+ 384.96743 163.0
[M-H]- 344.99699 159.4
[M+Na-2H]- 366.97894 163.5
[M]+ 346.00372 160.3
[M]- 346.00482 160.3
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.