CID 23423546

3-amino-2-methoxypropanoic acid hydrochloride

Structural Information

Molecular Formula

SMILES

COC(CN)C(=O)O

InChI

InChI=1S/C4H9NO3/c1-8-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)

InChIKey

NVUIQQXPQNPDCU-UHFFFAOYSA-N

Compound name

3-amino-2-methoxypropanoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 32
Patents: 119.05824 Da
Monoisotopic Mass: -3.5
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]+	120.06552	123.0
[M+Na]+	142.04746	129.5
[M-H]-	118.05096	121.7
[M+NH4]+	137.09206	144.1
[M+K]+	158.02140	130.2
[M+H-H2O]+	102.05550	118.4
[M+HCOO]-	164.05644	145.3
[M+CH3COO]-	178.07209	169.4
[M+Na-2H]-	140.03291	127.1
[M]+	119.05769	122.1
[M]-	119.05879	122.1

Literature stripe

literature stripe

Patent stripe

patents stripe