CID 605332

6-nitroquinolin-8-ol

Structural Information

Molecular Formula
C9H6N2O3
SMILES
C1=CC2=CC(=CC(=C2N=C1)O)[N+](=O)[O-]
InChI
InChI=1S/C9H6N2O3/c12-8-5-7(11(13)14)4-6-2-1-3-10-9(6)8/h1-5,12H
InChIKey
BVBQGQLGXJDKLZ-UHFFFAOYSA-N
Compound name
6-nitroquinolin-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

44
Patents

190.03784 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.04512 134.1
[M+Na]+ 213.02706 149.1
[M+NH4]+ 208.07166 142.7
[M+K]+ 229.00100 145.5
[M-H]- 189.03056 137.4
[M+Na-2H]- 211.01251 141.4
[M]+ 190.03729 137.1
[M]- 190.03839 137.1
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