CID 2724791

Methyl 2-hydroxy-2-methoxyacetate

Structural Information

Molecular Formula

C₄H₈O₄

SMILES

COC(C(=O)OC)O

InChI

InChI=1S/C4H8O4/c1-7-3(5)4(6)8-2/h3,5H,1-2H3

InChIKey

OVJJVYHDJVQFSF-UHFFFAOYSA-N

Compound name

methyl 2-hydroxy-2-methoxyacetate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 674
Patents: 120.04226 Da
Monoisotopic Mass: -0.6
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]+	121.049536	120.9
[M+Na]+	143.031478	128.4
[M-H]-	119.034984	120.3
[M+NH4]+	138.076083	142.7
[M+K]+	159.005418	130.0
[M+H-H2O]+	103.039520	116.8
[M+HCOO]-	165.040461	143.1
[M+CH3COO]-	179.056111	166.6
[M+Na-2H]-	141.016926	126.1
[M]+	120.04171142	123.3
[M]-	120.04280858	123.3

Literature stripe

literature stripe

Patent stripe

patents stripe