CID 22833604

113890-38-3

Structural Information

Molecular Formula

C₅H₁₀O₄

SMILES

C1[C@H]([C@@H](O[C@@H]1O)CO)O

InChI

InChI=1S/C5H10O4/c6-2-4-3(7)1-5(8)9-4/h3-8H,1-2H2/t3-,4+,5+/m1/s1

InChIKey

PDWIQYODPROSQH-WISUUJSJSA-N

Compound name

(2S,4R,5S)-5-(hydroxymethyl)oxolane-2,4-diol

Related CIDs

2D Structure

compound 2d structure

5
Annotation Hits: 0
References: 370
Patents: 134.0579 Da
Monoisotopic Mass: -1.0
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]+	135.06518	124.5
[M+Na]+	157.04712	132.9
[M+NH4]+	152.09172	131.4
[M+K]+	173.02106	132.2
[M-H]-	133.05062	124.4
[M+Na-2H]-	155.03257	125.9
[M]+	134.05735	125.2
[M]-	134.05845	125.2

Literature stripe

literature stripe

Patent stripe

patents stripe