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]+ 129.05463 121.5
[M+Na]+ 151.03657 129.6
[M-H]- 127.04007 127.1
[M+NH4]+ 146.08117 145.4
[M+K]+ 167.01051 131.3
[M+H-H2O]+ 111.04461 118.3
[M+HCOO]- 173.04555 143.0
[M+CH3COO]- 187.06120 167.8
[M+Na-2H]- 149.02202 127.9
[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

patents stripe