CID 63968157

5-(pyrazin-2-yl)pyridine-2-carboxylic acid

Structural Information

Molecular Formula

C₁₀H₇N₃O₂

SMILES

C1=CC(=NC=C1C2=NC=CN=C2)C(=O)O

InChI

InChI=1S/C10H7N3O2/c14-10(15)8-2-1-7(5-13-8)9-6-11-3-4-12-9/h1-6H,(H,14,15)

InChIKey

UKHFKTCQUPSESL-UHFFFAOYSA-N

Compound name

5-pyrazin-2-ylpyridine-2-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 15
Patents: 201.05383 Da
Monoisotopic Mass: 0.2
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]+	202.06111	141.7
[M+Na]+	224.04305	156.3
[M+NH4]+	219.08765	148.6
[M+K]+	240.01699	150.6
[M-H]-	200.04655	143.4
[M+Na-2H]-	222.02850	150.9
[M]+	201.05328	144.2
[M]-	201.05438	144.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe