CID 11052098

8-aminoquinoline-7-carboxaldehyde

Structural Information

Molecular Formula
C10H8N2O
SMILES
C1=CC2=C(C(=C(C=C2)C=O)N)N=C1
InChI
InChI=1S/C10H8N2O/c11-9-8(6-13)4-3-7-2-1-5-12-10(7)9/h1-6H,11H2
InChIKey
ZAMLCNSCTZZXCU-UHFFFAOYSA-N
Compound name
8-aminoquinoline-7-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

231
Patents

172.06366 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.07094 133.2
[M+Na]+ 195.05288 143.1
[M-H]- 171.05638 136.6
[M+NH4]+ 190.09748 153.1
[M+K]+ 211.02682 139.4
[M+H-H2O]+ 155.06092 126.6
[M+HCOO]- 217.06186 157.0
[M+CH3COO]- 231.07751 182.0
[M+Na-2H]- 193.03833 142.3
[M]+ 172.06311 132.7
[M]- 172.06421 132.7
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