| SpectraBase Compound ID | 8DN8fTPgT3M |
|---|---|
| InChI | InChI=1S/C14H20O/c1-2-14(15)12-8-4-7-11-13-9-5-3-6-10-13/h3,5-6,9-10H,2,4,7-8,11-12H2,1H3 |
| InChIKey | PCHVOQYBHKHPNX-UHFFFAOYSA-N |
| Mol Weight | 204.31 g/mol |
| Molecular Formula | C14H20O |
| Exact Mass | 204.151415 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | oWkOBwMgwp |
|---|---|
| Name | 8-Phenyloctan-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.151415263 u |
| Formula | C14H20O |
| InChI | InChI=1S/C14H20O/c1-2-14(15)12-8-4-7-11-13-9-5-3-6-10-13/h3,5-6,9-10H,2,4,7-8,11-12H2,1H3 |
| InChIKey | PCHVOQYBHKHPNX-UHFFFAOYSA-N |
| Molecular Weight | 204.313 g/mol |
| SMILES | C=1C=C(C=CC1)CCCCCC(CC)=O |