![2-[(E)-1-hydroxy-3-phenyl-allyl]cyclopentanone](/api/spectrum/8PAt5915Sjs/structure.png?h=300&w=458 "2-[(E)-1-hydroxy-3-phenyl-allyl]cyclopentanone")
| SpectraBase Compound ID | 1NHwsYmEUSQ |
|---|---|
| InChI | InChI=1S/C14H16O2/c15-13-8-4-7-12(13)14(16)10-9-11-5-2-1-3-6-11/h1-3,5-6,9-10,12,14,16H,4,7-8H2/b10-9+ |
| InChIKey | IIHRBBGFBIXMKQ-MDZDMXLPSA-N |
| Mol Weight | 216.28 g/mol |
| Molecular Formula | C14H16O2 |
| Exact Mass | 216.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8PAt5915Sjs |
|---|---|
| Name | 2-[(E)-1-Hydroxy-3-phenyl-allyl]cyclopentanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.115029753 u |
| Formula | C14H16O2 |
| InChI | InChI=1S/C14H16O2/c15-13-8-4-7-12(13)14(16)10-9-11-5-2-1-3-6-11/h1-3,5-6,9-10,12,14,16H,4,7-8H2/b10-9+ |
| InChIKey | IIHRBBGFBIXMKQ-MDZDMXLPSA-N |
| Molecular Weight | 216.280 g/mol |
| SMILES | C1(C(CCC1)C(\C=C\C=1C=CC=CC1)O)=O |