CID 12358757

Beta-d-xylulofuranose

Structural Information

Molecular Formula

C₅H₁₀O₅

SMILES

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

InChI

InChI=1S/C5H10O5/c6-2-5(9)4(8)3(7)1-10-5/h3-4,6-9H,1-2H2/t3-,4+,5-/m1/s1

InChIKey

LQXVFWRQNMEDEE-MROZADKFSA-N

Compound name

(2R,3S,4R)-2-(hydroxymethyl)oxolane-2,3,4-triol

Related CIDs

2D Structure

compound 2d structure

5
Annotation Hits: 0
References: 69
Patents: 150.05283 Da
Monoisotopic Mass: -2.2
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]+	151.06011	127.1
[M+Na]+	173.04205	134.6
[M+NH4]+	168.08665	134.5
[M+K]+	189.01599	133.1
[M-H]-	149.04555	125.9
[M+Na-2H]-	171.02750	129.2
[M]+	150.05228	127.4
[M]-	150.05338	127.4

Literature stripe

literature stripe

Patent stripe

patents stripe