CID 9942150

(3r,3as,6ar)-hexahydrofuro[2,3-b]furan-3-ol

Structural Information

Molecular Formula

C₆H₁₀O₃

SMILES

C1CO[C@H]2[C@@H]1[C@H](CO2)O

InChI

InChI=1S/C6H10O3/c7-5-3-9-6-4(5)1-2-8-6/h4-7H,1-3H2/t4-,5-,6+/m0/s1

InChIKey

RCDXYCHYMULCDZ-HCWXCVPCSA-N

Compound name

(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 394
Patents: 130.06299 Da
Monoisotopic Mass: -0.4
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]+	131.07027	123.1
[M+Na]+	153.05221	132.0
[M+NH4]+	148.09681	132.0
[M+K]+	169.02615	132.1
[M-H]-	129.05571	126.0
[M+Na-2H]-	151.03766	124.5
[M]+	130.06244	124.9
[M]-	130.06354	124.9

Literature stripe

literature stripe

Patent stripe

patents stripe