2-Benzoylcyclohexanone 2-苯甲酰环己酮
CAS 3580-38-9 MFCD00524769
化学结构图
SMILES: O=C1CCCCC1C(=O)c1ccccc1
化学属性
| Mol. Formula | C6H5COC6H9(=O) |
|---|---|
| Mol. Weight | 202.25 |
| Melting Point | 88-91 °C(lit.) |
别名和识别编码
| Chemical Name | 2-Benzoylcyclohexanone |
|---|---|
| MDL Number | MFCD00524769 |
| PubChem Substance ID | 275627 |
| CAS Number | 3580-38-9 |
| Synonym | 2-苯甲酰环己酮 2-benzoylcyclohexanone Cyclohexanone, 2-benzoyl- (R,S)-2-Benzoyl-cyclohexanone |
| Chemical Name Translation | 2-苯甲酰环己酮 |
| InChI | InChI=1S/C13H14O2/c14-12-9-5-4-8-11(12)13(15)10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2 |
| LabNetwork Molecule ID | LN00491501 |
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分类
- {uni_hamburg} no charge; carbocycle; aromatic; alicycle; 6RingOnly; 6ring; ketone; racemate; 1fragment
- Building Blocks, C13 to C14, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks
- {SA} Building Blocks, C13 to C14, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks
相关文献及参考
- Short: III/35E Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Oxygen-17 Author: Duddeck, H.; Toth, G.; Simon, A. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35E Year: 2002 Keyword: Alipathic and Aromatic hydrocarbons; Coupling constant j; Nuclear Magnetic Resonance; chemical shifts δ ISBN: 3-540-42501-2 ISBN: 978-3-540-42501-4 Internet Resource: DOI:10.1007/b92953 RefComment: VII, 230 pages. With CD-ROM., Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), carbon-13 (subvol. D), and oxygen-17 (subvol. E) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
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