CID 416002

5-aminoquinolin-8-ol

Structural Information

Molecular Formula
C9H8N2O
SMILES
C1=CC2=C(C=CC(=C2N=C1)O)N
InChI
InChI=1S/C9H8N2O/c10-7-3-4-8(12)9-6(7)2-1-5-11-9/h1-5,12H,10H2
InChIKey
YDEUKNRKEYICTH-UHFFFAOYSA-N
Compound name
5-aminoquinolin-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

18
References

2202
Patents

160.06366 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.07094 130.1
[M+Na]+ 183.05288 139.7
[M-H]- 159.05638 132.3
[M+NH4]+ 178.09748 149.9
[M+K]+ 199.02682 136.0
[M+H-H2O]+ 143.06092 124.0
[M+HCOO]- 205.06186 152.5
[M+CH3COO]- 219.07751 143.8
[M+Na-2H]- 181.03833 139.3
[M]+ 160.06311 128.1
[M]- 160.06421 128.1
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