CID 6324447

6,8-dimethoxy-2-methyl-1,4-dihydroquinolin-4-one

Structural Information

Molecular Formula
C12H13NO3
SMILES
CC1=CC(=O)C2=C(N1)C(=CC(=C2)OC)OC
InChI
InChI=1S/C12H13NO3/c1-7-4-10(14)9-5-8(15-2)6-11(16-3)12(9)13-7/h4-6H,1-3H3,(H,13,14)
InChIKey
HSWLTMTZQPZCEO-UHFFFAOYSA-N
Compound name
6,8-dimethoxy-2-methyl-1H-quinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

219.08954 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.09682 144.9
[M+Na]+ 242.07876 155.9
[M-H]- 218.08226 147.9
[M+NH4]+ 237.12336 163.3
[M+K]+ 258.05270 152.6
[M+H-H2O]+ 202.08680 138.4
[M+HCOO]- 264.08774 166.4
[M+CH3COO]- 278.10339 188.0
[M+Na-2H]- 240.06421 151.6
[M]+ 219.08899 148.6
[M]- 219.09009 148.6
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