CID 254168

6-amino-3-ethyl-4-methylquinolin-2(1h)-one

Structural Information

Molecular Formula
C12H14N2O
SMILES
CCC1=C(C2=C(C=CC(=C2)N)NC1=O)C
InChI
InChI=1S/C12H14N2O/c1-3-9-7(2)10-6-8(13)4-5-11(10)14-12(9)15/h4-6H,3,13H2,1-2H3,(H,14,15)
InChIKey
GMVZKFGGIOPWBO-UHFFFAOYSA-N
Compound name
6-amino-3-ethyl-4-methyl-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

202.11061 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.11789 143.8
[M+Na]+ 225.09983 154.3
[M-H]- 201.10333 146.2
[M+NH4]+ 220.14443 162.5
[M+K]+ 241.07377 149.3
[M+H-H2O]+ 185.10787 137.6
[M+HCOO]- 247.10881 165.3
[M+CH3COO]- 261.12446 188.1
[M+Na-2H]- 223.08528 149.7
[M]+ 202.11006 142.9
[M]- 202.11116 142.9
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

patents stripe