CID 54697292

3-(2-chlorobenzoyl)-4-hydroxy-2(1h)-quinolinone

Structural Information

Molecular Formula
C16H10ClNO3
SMILES
C1=CC=C2C(=C1)C(=C(C(=O)N2)C(=O)C3=CC=CC=C3Cl)O
InChI
InChI=1S/C16H10ClNO3/c17-11-7-3-1-5-9(11)14(19)13-15(20)10-6-2-4-8-12(10)18-16(13)21/h1-8H,(H2,18,20,21)
InChIKey
YFGPNCNXQWODDZ-UHFFFAOYSA-N
Compound name
3-(2-chlorobenzoyl)-4-hydroxy-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

299.0349 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.04218 163.9
[M+Na]+ 322.02412 180.8
[M+NH4]+ 317.06872 171.9
[M+K]+ 337.99806 172.9
[M-H]- 298.02762 167.5
[M+Na-2H]- 320.00957 172.2
[M]+ 299.03435 167.7
[M]- 299.03545 167.7
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