CID 165943125

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

Structural Information

Molecular Formula
C7H4F2O3
SMILES
C1C2=C(CC1(F)F)C(=O)OC2=O
InChI
InChI=1S/C7H4F2O3/c8-7(9)1-3-4(2-7)6(11)12-5(3)10/h1-2H2
InChIKey
DSJPYBMKIDODDB-UHFFFAOYSA-N
Compound name
5,5-difluoro-4,6-dihydrocyclopenta[c]furan-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

174.01285 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.02013 125.9
[M+Na]+ 197.00207 137.6
[M-H]- 173.00557 129.5
[M+NH4]+ 192.04667 151.8
[M+K]+ 212.97601 136.5
[M+H-H2O]+ 157.01011 121.7
[M+HCOO]- 219.01105 147.6
[M+CH3COO]- 233.02670 176.6
[M+Na-2H]- 194.98752 131.0
[M]+ 174.01230 125.3
[M]- 174.01340 125.3
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