CID 112757241

2664078-95-7

Structural Information

Molecular Formula

C₈H₁₀N₂O₂

SMILES

C1CNCC2=C1C(=CC(=O)N2)O

InChI

InChI=1S/C8H10N2O2/c11-7-3-8(12)10-6-4-9-2-1-5(6)7/h3,9H,1-2,4H2,(H2,10,11,12)

InChIKey

GMAIDQQVCWZJFM-UHFFFAOYSA-N

Compound name

4-hydroxy-5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 166.07423 Da
Monoisotopic Mass: -1.5
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]+	167.08151	133.4
[M+Na]+	189.06345	145.5
[M+NH4]+	184.10805	140.9
[M+K]+	205.03739	140.2
[M-H]-	165.06695	133.3
[M+Na-2H]-	187.04890	137.9
[M]+	166.07368	134.8
[M]-	166.07478	134.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe