CID 17896361
1-(2-methylbenzoyl)piperidin-4-one
Structural Information
- Molecular Formula
- C13H15NO2
- SMILES
- CC1=CC=CC=C1C(=O)N2CCC(=O)CC2
- InChI
- InChI=1S/C13H15NO2/c1-10-4-2-3-5-12(10)13(16)14-8-6-11(15)7-9-14/h2-5H,6-9H2,1H3
- InChIKey
- OXHVRXMYJFCTGL-UHFFFAOYSA-N
- Compound name
- 1-(2-methylbenzoyl)piperidin-4-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 218.11756 | 149.4 |
[M+Na]+ | 240.09950 | 162.2 |
[M+NH4]+ | 235.14410 | 157.5 |
[M+K]+ | 256.07344 | 155.5 |
[M-H]- | 216.10300 | 152.6 |
[M+Na-2H]- | 238.08495 | 156.3 |
[M]+ | 217.10973 | 152.0 |
[M]- | 217.11083 | 152.0 |
Literature stripe
No literature data available for this compound.