CID 168444591
Ethyl 2-(3,3-difluorocyclobutyl)acetate
Structural Information
- Molecular Formula
- C8H12F2O2
- SMILES
- CCOC(=O)CC1CC(C1)(F)F
- InChI
- InChI=1S/C8H12F2O2/c1-2-12-7(11)3-6-4-8(9,10)5-6/h6H,2-5H2,1H3
- InChIKey
- ZFDFOJNBPPOIJL-UHFFFAOYSA-N
- Compound name
- ethyl 2-(3,3-difluorocyclobutyl)acetate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 179.08782 | 145.1 |
[M+Na]+ | 201.06976 | 149.3 |
[M+NH4]+ | 196.11436 | 148.9 |
[M+K]+ | 217.04370 | 144.2 |
[M-H]- | 177.07326 | 140.1 |
[M+Na-2H]- | 199.05521 | 146.2 |
[M]+ | 178.07999 | 142.9 |
[M]- | 178.08109 | 142.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.