CID 4653788

2-amino-8-quinolinol

Structural Information

Molecular Formula
C9H8N2O
SMILES
C1=CC2=C(C(=C1)O)N=C(C=C2)N
InChI
InChI=1S/C9H8N2O/c10-8-5-4-6-2-1-3-7(12)9(6)11-8/h1-5,12H,(H2,10,11)
InChIKey
UFVLIVCXTIGACT-UHFFFAOYSA-N
Compound name
2-aminoquinolin-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

374
Patents

160.06366 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.070936 130.1
[M+Na]+ 183.052878 139.7
[M-H]- 159.056384 132.3
[M+NH4]+ 178.097483 149.9
[M+K]+ 199.026818 136.0
[M+H-H2O]+ 143.060920 124.0
[M+HCOO]- 205.061861 152.5
[M+CH3COO]- 219.077511 143.8
[M+Na-2H]- 181.038326 139.3
[M]+ 160.06311142 128.1
[M]- 160.06420858 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