CID 13353749

93129-56-7

Structural Information

Molecular Formula

C₉H₈N₂O₃

SMILES

CCOC(=O)C1=NC2=C(O1)C=CC=N2

InChI

InChI=1S/C9H8N2O3/c1-2-13-9(12)8-11-7-6(14-8)4-3-5-10-7/h3-5H,2H2,1H3

InChIKey

KRPJHFZZVZJQES-UHFFFAOYSA-N

Compound name

ethyl [1,3]oxazolo[4,5-b]pyridine-2-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 192.0535 Da
Monoisotopic Mass: 1.6
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]+	193.06078	137.0
[M+Na]+	215.04272	150.4
[M+NH4]+	210.08732	144.4
[M+K]+	231.01666	147.2
[M-H]-	191.04622	138.5
[M+Na-2H]-	213.02817	142.7
[M]+	192.05295	139.2
[M]-	192.05405	139.2

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.