CID 760

Glyoxylic acid

Structural Information

Molecular Formula

C₂H₂O₃

SMILES

C(=O)C(=O)O

InChI

InChI=1S/C2H2O3/c3-1-2(4)5/h1H,(H,4,5)

InChIKey

HHLFWLYXYJOTON-UHFFFAOYSA-N

Compound name

oxaldehydic acid

Related CIDs

2D Structure

compound 2d structure

10
Annotation Hits: 2241
References: 92321
Patents: 74.0004 Da
Monoisotopic Mass: -0.3
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]+	75.007676	106.9
[M+Na]+	96.989618	115.7
[M-H]-	72.993124	106.6
[M+NH4]+	92.034223	130.4
[M+K]+	112.96356	116.3
[M+H-H2O]+	56.997660	103.4
[M+HCOO]-	118.99860	130.7
[M+CH3COO]-	133.01425	157.2
[M+Na-2H]-	94.975066	114.5
[M]+	73.999851	107.1
[M]-	74.000949	107.1

Literature stripe

literature stripe

Patent stripe

patents stripe