CID 4739097

Pyrido[2,3-b]pyrazine-7-carboxylic acid

Structural Information

Molecular Formula

C₈H₅N₃O₂

SMILES

C1=CN=C2C(=N1)C=C(C=N2)C(=O)O

InChI

InChI=1S/C8H5N3O2/c12-8(13)5-3-6-7(11-4-5)10-2-1-9-6/h1-4H,(H,12,13)

InChIKey

SMPGSEFDPLFZJS-UHFFFAOYSA-N

Compound name

pyrido[2,3-b]pyrazine-7-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 175.03818 Da
Monoisotopic Mass: 0.0
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]+	176.04546	133.9
[M+Na]+	198.02740	148.0
[M+NH4]+	193.07200	141.2
[M+K]+	214.00134	142.6
[M-H]-	174.03090	134.0
[M+Na-2H]-	196.01285	140.9
[M]+	175.03763	135.8
[M]-	175.03873	135.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe