CID 135687094

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

Structural Information

Molecular Formula
C18H15NO5
SMILES
COC1=CC(=C(C=C1)C(=O)C2=C(C3=CC=CC=C3NC2=O)O)OC
InChI
InChI=1S/C18H15NO5/c1-23-10-7-8-12(14(9-10)24-2)17(21)15-16(20)11-5-3-4-6-13(11)19-18(15)22/h3-9H,1-2H3,(H2,19,20,22)
InChIKey
DVYMTXAIELKZDL-UHFFFAOYSA-N
Compound name
3-(2,4-dimethoxybenzoyl)-4-hydroxy-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

325.09503 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.10231 173.5
[M+Na]+ 348.08425 188.5
[M+NH4]+ 343.12885 179.7
[M+K]+ 364.05819 182.4
[M-H]- 324.08775 176.0
[M+Na-2H]- 346.06970 180.0
[M]+ 325.09448 176.3
[M]- 325.09558 176.3
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