CID 4912759

6-amino-3,4-dihydroquinolin-2(1h)-one

Structural Information

Molecular Formula
C9H10N2O
SMILES
C1CC(=O)NC2=C1C=C(C=C2)N
InChI
InChI=1S/C9H10N2O/c10-7-2-3-8-6(5-7)1-4-9(12)11-8/h2-3,5H,1,4,10H2,(H,11,12)
InChIKey
NFWVCYWFUIFIKU-UHFFFAOYSA-N
Compound name
6-amino-3,4-dihydro-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

326
Patents

162.07932 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.08660 132.1
[M+Na]+ 185.06854 139.9
[M-H]- 161.07204 133.5
[M+NH4]+ 180.11314 151.5
[M+K]+ 201.04248 136.0
[M+H-H2O]+ 145.07658 125.9
[M+HCOO]- 207.07752 151.7
[M+CH3COO]- 221.09317 177.1
[M+Na-2H]- 183.05399 139.1
[M]+ 162.07877 126.4
[M]- 162.07987 126.4
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