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]+ 129.054626 121.2
[M+Na]+ 151.036568 129.5
[M-H]- 127.040074 125.8
[M+NH4]+ 146.081173 144.6
[M+K]+ 167.010508 130.8
[M+H-H2O]+ 111.044610 118.1
[M+HCOO]- 173.045551 142.4
[M+CH3COO]- 187.061201 165.6
[M+Na-2H]- 149.022016 128.1
[M]+ 128.04680142 121.5
[M]- 128.04789858 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.