CID 16684381

Quinoline, 5-nitro-8-(stibosooxy)-

Structural Information

Molecular Formula
C9H5N2O4Sb
SMILES
C1=CC2=C(C=CC(=C2N=C1)O[Sb]=O)[N+](=O)[O-]
InChI
InChI=1S/C9H6N2O3.O.Sb/c12-8-4-3-7(11(13)14)6-2-1-5-10-9(6)8;;/h1-5,12H;;/q;;+1/p-1
InChIKey
DQULRRCXSBIVKH-UHFFFAOYSA-M
Compound name
(5-nitroquinolin-8-yl)oxy-oxostibane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.92874 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.93602 161.6
[M+Na]+ 348.91796 169.4
[M-H]- 324.92146 164.5
[M+NH4]+ 343.96256 177.6
[M+K]+ 364.89190 162.6
[M+H-H2O]+ 308.92600 157.7
[M+HCOO]- 370.92694 184.8
[M+CH3COO]- 384.94259 185.4
[M+Na-2H]- 346.90341 170.3
[M]+ 325.92819 162.7
[M]- 325.92929 162.7
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.