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
2
Annotation Hits

0
References

1722
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

literature stripe

Patent stripe

patents stripe