CID 121230968

2260937-10-6

Structural Information

Molecular Formula

C₆H₅FN₂O₂

SMILES

C1=C(C(=CN=C1C(=O)O)F)N

InChI

InChI=1S/C6H5FN2O2/c7-3-2-9-5(6(10)11)1-4(3)8/h1-2H,(H2,8,9)(H,10,11)

InChIKey

KURRXXFKJGCBOT-UHFFFAOYSA-N

Compound name

4-amino-5-fluoropyridine-2-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 14
Patents: 156.03351 Da
Monoisotopic Mass: 0.1
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]+	157.04079	128.1
[M+Na]+	179.02273	138.8
[M+NH4]+	174.06733	134.6
[M+K]+	194.99667	134.9
[M-H]-	155.02623	127.3
[M+Na-2H]-	177.00818	133.1
[M]+	156.03296	129.0
[M]-	156.03406	129.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe