CID 5481689

5-chloro-7-morpholino-1,8-naphthyridin-2-ol

Structural Information

Molecular Formula

C₁₂H₁₂ClN₃O₂

SMILES

C1COCCN1C2=NC3=C(C=CC(=O)N3)C(=C2)Cl

InChI

InChI=1S/C12H12ClN3O2/c13-9-7-10(16-3-5-18-6-4-16)14-12-8(9)1-2-11(17)15-12/h1-2,7H,3-6H2,(H,14,15,17)

InChIKey

LJLIQACGJLLSIV-UHFFFAOYSA-N

Compound name

5-chloro-7-morpholin-4-yl-1H-1,8-naphthyridin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 265.0618 Da
Monoisotopic Mass: 1.3
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]+	266.069076	157.3
[M+Na]+	288.051018	166.4
[M-H]-	264.054524	159.6
[M+NH4]+	283.095623	169.4
[M+K]+	304.024958	161.3
[M+H-H2O]+	248.059060	147.9
[M+HCOO]-	310.060001	167.1
[M+CH3COO]-	324.075651	167.7
[M+Na-2H]-	286.036466	163.7
[M]+	265.06125142	155.7
[M]-	265.06234858	155.7

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.