CID 5325915

D-erythronolactone

Structural Information

Molecular Formula

C₄H₆O₄

SMILES

C1[C@H]([C@H](C(=O)O1)O)O

InChI

InChI=1S/C4H6O4/c5-2-1-8-4(7)3(2)6/h2-3,5-6H,1H2/t2-,3-/m1/s1

InChIKey

SGMJBNSHAZVGMC-PWNYCUMCSA-N

Compound name

(3R,4R)-3,4-dihydroxyoxolan-2-one

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 46
References: 1200
Patents: 118.02661 Da
Monoisotopic Mass: -1.3
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]+	119.03389	117.7
[M+Na]+	141.01583	126.2
[M-H]-	117.01933	119.8
[M+NH4]+	136.06043	139.5
[M+K]+	156.98977	126.5
[M+H-H2O]+	101.02387	114.0
[M+HCOO]-	163.02481	138.8
[M+CH3COO]-	177.04046	161.4
[M+Na-2H]-	139.00128	123.2
[M]+	118.02606	116.3
[M]-	118.02716	116.3

Literature stripe

literature stripe

Patent stripe

patents stripe