CID 165601840
2731009-77-9
Structural Information
- Molecular Formula
- C8H8F2O3
- SMILES
- C1C(C2(C1=O)CC(C2)(F)F)C(=O)O
- InChI
- InChI=1S/C8H8F2O3/c9-8(10)2-7(3-8)4(6(12)13)1-5(7)11/h4H,1-3H2,(H,12,13)
- InChIKey
- NQWVNUCULQCCIE-UHFFFAOYSA-N
- Compound name
- 6,6-difluoro-3-oxospiro[3.3]heptane-1-carboxylic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 191.05142 | 134.2 |
[M+Na]+ | 213.03336 | 140.5 |
[M-H]- | 189.03686 | 136.9 |
[M+NH4]+ | 208.07796 | 143.8 |
[M+K]+ | 229.00730 | 144.0 |
[M+H-H2O]+ | 173.04140 | 122.1 |
[M+HCOO]- | 235.04234 | 149.3 |
[M+CH3COO]- | 249.05799 | 191.9 |
[M+Na-2H]- | 211.01881 | 137.9 |
[M]+ | 190.04359 | 147.2 |
[M]- | 190.04469 | 147.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.