CID 130761639

(3s,3ar,6ar)-2h,3h,3ah,6ah-furo[3,2-b]furan-3-ol

Structural Information

Molecular Formula
C6H8O3
SMILES
C1[C@@H]([C@@H]2[C@H](O1)C=CO2)O
InChI
InChI=1S/C6H8O3/c7-4-3-9-5-1-2-8-6(4)5/h1-2,4-7H,3H2/t4-,5+,6+/m0/s1
InChIKey
RMWKNPUEMIQVLB-KVQBGUIXSA-N
Compound name
(3S,3aR,6aR)-2,3,3a,6a-tetrahydrofuro[3,2-b]furan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

128.04735 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.05463 121.2
[M+Na]+ 151.03657 129.5
[M-H]- 127.04007 125.8
[M+NH4]+ 146.08117 144.6
[M+K]+ 167.01051 130.8
[M+H-H2O]+ 111.04461 118.1
[M+HCOO]- 173.04555 142.4
[M+CH3COO]- 187.06120 165.6
[M+Na-2H]- 149.02202 128.1
[M]+ 128.04680 121.5
[M]- 128.04790 121.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.