CID 75481473

4h,5h,6h-cyclopenta[c]furan-1-carboxylic acid

Structural Information

Molecular Formula
C8H8O3
SMILES
C1CC2=COC(=C2C1)C(=O)O
InChI
InChI=1S/C8H8O3/c9-8(10)7-6-3-1-2-5(6)4-11-7/h4H,1-3H2,(H,9,10)
InChIKey
UIKXPQHSUCBEDS-UHFFFAOYSA-N
Compound name
5,6-dihydro-4H-cyclopenta[c]furan-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.04735 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.054626 129.0
[M+Na]+ 175.036568 137.5
[M-H]- 151.040074 133.3
[M+NH4]+ 170.081173 152.7
[M+K]+ 191.010508 137.1
[M+H-H2O]+ 135.044610 125.3
[M+HCOO]- 197.045551 151.2
[M+CH3COO]- 211.061201 171.1
[M+Na-2H]- 173.022016 133.7
[M]+ 152.04680142 129.6
[M]- 152.04789858 129.6
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.