CID 10094241

2-amino-n-(quinolin-8-yl)acetamide

Structural Information

Molecular Formula
C11H11N3O
SMILES
C1=CC2=C(C(=C1)NC(=O)CN)N=CC=C2
InChI
InChI=1S/C11H11N3O/c12-7-10(15)14-9-5-1-3-8-4-2-6-13-11(8)9/h1-6H,7,12H2,(H,14,15)
InChIKey
RBKYJYFSMHPAFS-UHFFFAOYSA-N
Compound name
2-amino-N-quinolin-8-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

4
Patents

201.09021 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.09749 141.6
[M+Na]+ 224.07943 148.9
[M-H]- 200.08293 144.4
[M+NH4]+ 219.12403 159.6
[M+K]+ 240.05337 145.5
[M+H-H2O]+ 184.08747 134.2
[M+HCOO]- 246.08841 165.0
[M+CH3COO]- 260.10406 189.1
[M+Na-2H]- 222.06488 150.1
[M]+ 201.08966 139.5
[M]- 201.09076 139.5
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