| SpectraBase Compound ID | AFvVmY0RuQG |
|---|---|
| InChI | InChI=1S/C17H22O/c1-2-3-4-8-14-17(18)15-10-9-13-16-11-6-5-7-12-16/h5-7,9-13,15H,2-4,8,14H2,1H3/b13-9+,15-10+ |
| InChIKey | RBJSSKXGUSMQPC-XHWVFBAXSA-N |
| Mol Weight | 242.36 g/mol |
| Molecular Formula | C17H22O |
| Exact Mass | 242.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CsmFymssNJr |
|---|---|
| Name | 1,3-Undecadien-5-one, 1-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.167065327 u |
| Formula | C17H22O |
| InChI | InChI=1S/C17H22O/c1-2-3-4-8-14-17(18)15-10-9-13-16-11-6-5-7-12-16/h5-7,9-13,15H,2-4,8,14H2,1H3/b13-9+,15-10+ |
| InChIKey | RBJSSKXGUSMQPC-XHWVFBAXSA-N |
| Molecular Weight | 242.362 g/mol |
| SMILES | C1(\C=C\C=C\C(CCCCCC)=O)=CC=CC=C1 |