CID 327360

6759-51-9

Structural Information

Molecular Formula
C11H12N2O
SMILES
CC1=CC(=O)N(C2=C1C=C(C=C2)N)C
InChI
InChI=1S/C11H12N2O/c1-7-5-11(14)13(2)10-4-3-8(12)6-9(7)10/h3-6H,12H2,1-2H3
InChIKey
YFCNDZIWOBMIEL-UHFFFAOYSA-N
Compound name
6-amino-1,4-dimethylquinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

14
Patents

188.09496 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.10224 138.5
[M+Na]+ 211.08418 149.8
[M-H]- 187.08768 142.5
[M+NH4]+ 206.12878 158.5
[M+K]+ 227.05812 146.0
[M+H-H2O]+ 171.09222 132.2
[M+HCOO]- 233.09316 161.9
[M+CH3COO]- 247.10881 187.5
[M+Na-2H]- 209.06963 145.5
[M]+ 188.09441 139.1
[M]- 188.09551 139.1
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