CID 83708053
1-(4-fluorophenyl)-3,3-dimethylpiperazin-2-one
Structural Information
- Molecular Formula
- C12H15FN2O
- SMILES
- CC1(C(=O)N(CCN1)C2=CC=C(C=C2)F)C
- InChI
- InChI=1S/C12H15FN2O/c1-12(2)11(16)15(8-7-14-12)10-5-3-9(13)4-6-10/h3-6,14H,7-8H2,1-2H3
- InChIKey
- CLLYMBGVWOUTQJ-UHFFFAOYSA-N
- Compound name
- 1-(4-fluorophenyl)-3,3-dimethylpiperazin-2-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 223.12412 | 149.6 |
[M+Na]+ | 245.10606 | 157.7 |
[M-H]- | 221.10956 | 151.0 |
[M+NH4]+ | 240.15066 | 166.6 |
[M+K]+ | 261.08000 | 153.5 |
[M+H-H2O]+ | 205.11410 | 141.1 |
[M+HCOO]- | 267.11504 | 165.5 |
[M+CH3COO]- | 281.13069 | 186.6 |
[M+Na-2H]- | 243.09151 | 153.6 |
[M]+ | 222.11629 | 144.0 |
[M]- | 222.11739 | 144.0 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.