CID 10964515

Hexahydrofuro[2,3-b]furan-2-one

Structural Information

Molecular Formula
C6H8O3
SMILES
C1COC2C1CC(=O)O2
InChI
InChI=1S/C6H8O3/c7-5-3-4-1-2-8-6(4)9-5/h4,6H,1-3H2
InChIKey
IADWRRHAUNBWTI-UHFFFAOYSA-N
Compound name
3,3a,4,6a-tetrahydro-2H-furo[2,3-b]furan-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

128.04735 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.054626 121.5
[M+Na]+ 151.036568 129.6
[M-H]- 127.040074 127.1
[M+NH4]+ 146.081173 145.4
[M+K]+ 167.010508 131.3
[M+H-H2O]+ 111.044610 118.3
[M+HCOO]- 173.045551 143.0
[M+CH3COO]- 187.061201 167.8
[M+Na-2H]- 149.022016 127.9
[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.