CID 77230326
162368-02-7
Structural Information
- Molecular Formula
- C9H14BrNO2
- SMILES
- CC(=O)N1CCC(CC1)C(=O)CBr
- InChI
- InChI=1S/C9H14BrNO2/c1-7(12)11-4-2-8(3-5-11)9(13)6-10/h8H,2-6H2,1H3
- InChIKey
- SJHFANAAUIRSLR-UHFFFAOYSA-N
- Compound name
- 1-(1-acetylpiperidin-4-yl)-2-bromoethanone
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 248.02806 | 147.6 |
[M+Na]+ | 270.01000 | 156.2 |
[M-H]- | 246.01350 | 151.8 |
[M+NH4]+ | 265.05460 | 167.1 |
[M+K]+ | 285.98394 | 146.4 |
[M+H-H2O]+ | 230.01804 | 147.3 |
[M+HCOO]- | 292.01898 | 163.2 |
[M+CH3COO]- | 306.03463 | 189.6 |
[M+Na-2H]- | 267.99545 | 151.0 |
[M]+ | 247.02023 | 163.1 |
[M]- | 247.02133 | 163.1 |
Literature stripe
No literature data available for this compound.