CID 13669242

Isoxazolo(4,5-c)quinolin-3(2h)-one, 8-chloro-2-phenyl-

Structural Information

Molecular Formula
C16H9ClN2O2
SMILES
C1=CC=C(C=C1)N2C(=O)C3=CN=C4C=CC(=CC4=C3O2)Cl
InChI
InChI=1S/C16H9ClN2O2/c17-10-6-7-14-12(8-10)15-13(9-18-14)16(20)19(21-15)11-4-2-1-3-5-11/h1-9H
InChIKey
DQWAAGGHVNDUSR-UHFFFAOYSA-N
Compound name
8-chloro-2-phenyl-[1,2]oxazolo[4,5-c]quinolin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

296.03525 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.04253 162.5
[M+Na]+ 319.02447 182.4
[M+NH4]+ 314.06907 172.2
[M+K]+ 334.99841 174.6
[M-H]- 295.02797 168.9
[M+Na-2H]- 317.00992 172.0
[M]+ 296.03470 167.8
[M]- 296.03580 167.8
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