CID 878295

6-chloro-4-phenyl-1,2-dihydroquinolin-2-one

Structural Information

Molecular Formula
C15H10ClNO
SMILES
C1=CC=C(C=C1)C2=CC(=O)NC3=C2C=C(C=C3)Cl
InChI
InChI=1S/C15H10ClNO/c16-11-6-7-14-13(8-11)12(9-15(18)17-14)10-4-2-1-3-5-10/h1-9H,(H,17,18)
InChIKey
IJUHQVBVAUVMEG-UHFFFAOYSA-N
Compound name
6-chloro-4-phenyl-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

11
References

22
Patents

255.04509 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.05237 153.3
[M+Na]+ 278.03431 164.4
[M-H]- 254.03781 158.7
[M+NH4]+ 273.07891 170.3
[M+K]+ 294.00825 156.8
[M+H-H2O]+ 238.04235 146.0
[M+HCOO]- 300.04329 170.1
[M+CH3COO]- 314.05894 165.9
[M+Na-2H]- 276.01976 160.9
[M]+ 255.04454 154.3
[M]- 255.04564 154.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe