| SpectraBase Compound ID | ALNztwnNClw |
|---|---|
| InChI | InChI=1S/C15H20O/c1-3-5-6-7-8-13-9-11-14(12-10-13)15(16)4-2/h4,9-12H,2-3,5-8H2,1H3 |
| InChIKey | IINHTEWASPUCMH-UHFFFAOYSA-N |
| Mol Weight | 216.32 g/mol |
| Molecular Formula | C15H20O |
| Exact Mass | 216.151415 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3FR6SzoxFSF |
|---|---|
| Name | 1-(4-Hexylphenyl)-2-propen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.151415263 u |
| Formula | C15H20O |
| InChI | InChI=1S/C15H20O/c1-3-5-6-7-8-13-9-11-14(12-10-13)15(16)4-2/h4,9-12H,2-3,5-8H2,1H3 |
| InChIKey | IINHTEWASPUCMH-UHFFFAOYSA-N |
| Molecular Weight | 216.324 g/mol |
| SMILES | C(C=1C=CC(=CC1)CCCCCC)(C=C)=O |