CID 23365713
2-cyclohexyl-2,2-difluoroacetic acid
Structural Information
- Molecular Formula
- C8H12F2O2
- SMILES
- C1CCC(CC1)C(C(=O)O)(F)F
- InChI
- InChI=1S/C8H12F2O2/c9-8(10,7(11)12)6-4-2-1-3-5-6/h6H,1-5H2,(H,11,12)
- InChIKey
- CYEMJDCNRYXDDT-UHFFFAOYSA-N
- Compound name
- 2-cyclohexyl-2,2-difluoroacetic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 179.08782 | 140.5 |
[M+Na]+ | 201.06976 | 147.7 |
[M+NH4]+ | 196.11436 | 146.7 |
[M+K]+ | 217.04370 | 143.7 |
[M-H]- | 177.07326 | 137.5 |
[M+Na-2H]- | 199.05521 | 142.8 |
[M]+ | 178.07999 | 140.2 |
[M]- | 178.08109 | 140.2 |
Literature stripe
No literature data available for this compound.