CID 50989585

8-aminoquinoline-6-carboxamide

Structural Information

Molecular Formula
C10H9N3O
SMILES
C1=CC2=CC(=CC(=C2N=C1)N)C(=O)N
InChI
InChI=1S/C10H9N3O/c11-8-5-7(10(12)14)4-6-2-1-3-13-9(6)8/h1-5H,11H2,(H2,12,14)
InChIKey
CALAXOYLLWFPLZ-UHFFFAOYSA-N
Compound name
8-aminoquinoline-6-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.07455 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.08183 137.8
[M+Na]+ 210.06377 146.5
[M-H]- 186.06727 140.7
[M+NH4]+ 205.10837 156.4
[M+K]+ 226.03771 143.0
[M+H-H2O]+ 170.07181 130.9
[M+HCOO]- 232.07275 160.9
[M+CH3COO]- 246.08840 187.4
[M+Na-2H]- 208.04922 145.0
[M]+ 187.07400 134.9
[M]- 187.07510 134.9
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.