CID 413874

2-[(pyridin-4-yl)amino]acetic acid hydrochloride

Structural Information

Molecular Formula

C₇H₈N₂O₂

SMILES

C1=CN=CC=C1NCC(=O)O

InChI

InChI=1S/C7H8N2O2/c10-7(11)5-9-6-1-3-8-4-2-6/h1-4H,5H2,(H,8,9)(H,10,11)

InChIKey

GEQSSRNYNMKRHP-UHFFFAOYSA-N

Compound name

2-(pyridin-4-ylamino)acetic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 40
Patents: 152.05858 Da
Monoisotopic Mass: 0.4
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	129.1
[M+Na]+	175.04780	136.0
[M-H]-	151.05130	130.0
[M+NH4]+	170.09240	147.6
[M+K]+	191.02174	134.3
[M+H-H2O]+	135.05584	122.5
[M+HCOO]-	197.05678	152.2
[M+CH3COO]-	211.07243	174.1
[M+Na-2H]-	173.03325	137.0
[M]+	152.05803	127.6
[M]-	152.05913	127.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe