CID 145782

3-amino-6-chloro-1-methyl-4-phenylquinolin-2(1h)-one

Structural Information

Molecular Formula
C16H13ClN2O
SMILES
CN1C2=C(C=C(C=C2)Cl)C(=C(C1=O)N)C3=CC=CC=C3
InChI
InChI=1S/C16H13ClN2O/c1-19-13-8-7-11(17)9-12(13)14(15(18)16(19)20)10-5-3-2-4-6-10/h2-9H,18H2,1H3
InChIKey
GHUMMQSCMAWOQZ-UHFFFAOYSA-N
Compound name
3-amino-6-chloro-1-methyl-4-phenylquinolin-2-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

284.07166 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.078936 163.6
[M+Na]+ 307.060878 175.6
[M-H]- 283.064384 170.3
[M+NH4]+ 302.105483 180.1
[M+K]+ 323.034818 168.3
[M+H-H2O]+ 267.068920 155.9
[M+HCOO]- 329.069861 181.8
[M+CH3COO]- 343.085511 176.2
[M+Na-2H]- 305.046326 168.9
[M]+ 284.07111142 165.9
[M]- 284.07220858 165.9
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

No patent data available for this compound.