CID 5057699

59966-29-9

Structural Information

Molecular Formula

C₇H₈N₂O₂

SMILES

C1=CC(=CN=C1)C(C(=O)O)N

InChI

InChI=1S/C7H8N2O2/c8-6(7(10)11)5-2-1-3-9-4-5/h1-4,6H,8H2,(H,10,11)

InChIKey

WJKDJKGHCRHSLB-UHFFFAOYSA-N

Compound name

2-amino-2-pyridin-3-ylacetic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 38
Patents: 152.05858 Da
Monoisotopic Mass: -2.8
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]+	153.06586	130.1
[M+Na]+	175.04780	140.5
[M+NH4]+	170.09240	137.1
[M+K]+	191.02174	136.7
[M-H]-	151.05130	130.5
[M+Na-2H]-	173.03325	135.7
[M]+	152.05803	131.3
[M]-	152.05913	131.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe