CID 76971091

1328893-14-6

Structural Information

Molecular Formula

C₁₃H₈Cl₂N₂O

SMILES

CC1=CC(=CC2=C1N=C3C(=CC=CN3C2=O)Cl)Cl

InChI

InChI=1S/C13H8Cl2N2O/c1-7-5-8(14)6-9-11(7)16-12-10(15)3-2-4-17(12)13(9)18/h2-6H,1H3

InChIKey

HWZYDXZSGZCNEA-UHFFFAOYSA-N

Compound name

2,6-dichloro-4-methylpyrido[2,1-b]quinazolin-11-one

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 0
References: 0
Patents: 278.00137 Da
Monoisotopic Mass: 3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	279.00865	155.4
[M+Na]+	300.99059	175.8
[M+NH4]+	296.03519	165.5
[M+K]+	316.96453	165.5
[M-H]-	276.99409	159.1
[M+Na-2H]-	298.97604	164.3
[M]+	278.00082	160.3
[M]-	278.00192	160.3

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.