CID 16684351

42324-04-9

Structural Information

Molecular Formula
C9H6BiNO
SMILES
C1=CC2=C(C(=C1)O[Bi])N=CC=C2
InChI
InChI=1S/C9H7NO.Bi/c11-8-5-1-3-7-4-2-6-10-9(7)8;/h1-6,11H;/q;+1/p-1
InChIKey
JIPZHVIPPSJMJK-UHFFFAOYSA-M
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.02533 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.03261 168.3
[M+Na]+ 376.01455 176.1
[M-H]- 352.01805 170.2
[M+NH4]+ 371.05915 186.9
[M+K]+ 391.98849 172.4
[M+H-H2O]+ 336.02259 159.5
[M+HCOO]- 398.02353 189.2
[M+CH3COO]- 412.03918 185.3
[M+Na-2H]- 374.00000 174.5
[M]+ 353.02478 169.6
[M]- 353.02588 169.6
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.