CID 135687097

3-(3,4-dimethoxybenzoyl)-4-hydroxy-8-methyl-2(1h)-quinolinone

Structural Information

Molecular Formula
C19H17NO5
SMILES
CC1=C2C(=CC=C1)C(=C(C(=O)N2)C(=O)C3=CC(=C(C=C3)OC)OC)O
InChI
InChI=1S/C19H17NO5/c1-10-5-4-6-12-16(10)20-19(23)15(18(12)22)17(21)11-7-8-13(24-2)14(9-11)25-3/h4-9H,1-3H3,(H2,20,22,23)
InChIKey
HYRFFLWKXOXOSF-UHFFFAOYSA-N
Compound name
3-(3,4-dimethoxybenzoyl)-4-hydroxy-8-methyl-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

339.1107 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.11798 178.1
[M+Na]+ 362.09992 193.3
[M+NH4]+ 357.14452 184.1
[M+K]+ 378.07386 187.1
[M-H]- 338.10342 180.7
[M+Na-2H]- 360.08537 184.1
[M]+ 339.11015 181.0
[M]- 339.11125 181.0
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