CID 47002711
1-(2,2-difluoroethyl)piperidin-4-one
Structural Information
- Molecular Formula
- C7H11F2NO
- SMILES
- C1CN(CCC1=O)CC(F)F
- InChI
- InChI=1S/C7H11F2NO/c8-7(9)5-10-3-1-6(11)2-4-10/h7H,1-5H2
- InChIKey
- DYLIPBUMUVWHAZ-UHFFFAOYSA-N
- Compound name
- 1-(2,2-difluoroethyl)piperidin-4-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 164.08815 | 132.1 |
[M+Na]+ | 186.07009 | 138.2 |
[M-H]- | 162.07359 | 131.0 |
[M+NH4]+ | 181.11469 | 151.2 |
[M+K]+ | 202.04403 | 137.0 |
[M+H-H2O]+ | 146.07813 | 124.1 |
[M+HCOO]- | 208.07907 | 148.9 |
[M+CH3COO]- | 222.09472 | 177.6 |
[M+Na-2H]- | 184.05554 | 135.2 |
[M]+ | 163.08032 | 125.6 |
[M]- | 163.08142 | 125.6 |
Literature stripe
No literature data available for this compound.