CID 324854

1h,3h,4h,5h,6h-cyclopenta[c]furan-1,3-dione

Structural Information

Molecular Formula
C7H6O3
SMILES
C1CC2=C(C1)C(=O)OC2=O
InChI
InChI=1S/C7H6O3/c8-6-4-2-1-3-5(4)7(9)10-6/h1-3H2
InChIKey
GBBPFLCLIBNHQO-UHFFFAOYSA-N
Compound name
5,6-dihydro-4H-cyclopenta[c]furan-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1714
Patents

138.0317 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.03898 122.9
[M+Na]+ 161.02092 132.7
[M-H]- 137.02442 128.7
[M+NH4]+ 156.06552 148.1
[M+K]+ 176.99486 132.6
[M+H-H2O]+ 121.02896 119.6
[M+HCOO]- 183.02990 146.7
[M+CH3COO]- 197.04555 170.5
[M+Na-2H]- 159.00637 128.3
[M]+ 138.03115 123.8
[M]- 138.03225 123.8
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