CID 268319

4-methyl-1,8-naphthyridine-2,7-diol

Structural Information

Molecular Formula

C₉H₈N₂O₂

SMILES

CC1=CC(=O)NC2=C1C=CC(=O)N2

InChI

InChI=1S/C9H8N2O2/c1-5-4-8(13)11-9-6(5)2-3-7(12)10-9/h2-4H,1H3,(H2,10,11,12,13)

InChIKey

DYXXFJOZBXIFML-UHFFFAOYSA-N

Compound name

4-methyl-1,8-dihydro-1,8-naphthyridine-2,7-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 176.05858 Da
Monoisotopic Mass: -0.7
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]+	177.06586	134.2
[M+Na]+	199.04780	148.9
[M+NH4]+	194.09240	141.7
[M+K]+	215.02174	142.7
[M-H]-	175.05130	134.7
[M+Na-2H]-	197.03325	140.5
[M]+	176.05803	136.3
[M]-	176.05913	136.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe