![1-{exo-Bicyclo[2.2.1]heptan-2-yl}-3-phenylpropan-1-one](/api/spectrum/9jphSEmLHAE/structure.png?h=300&w=458 "1-{exo-Bicyclo[2.2.1]heptan-2-yl}-3-phenylpropan-1-one")
| SpectraBase Compound ID | KcBkhKmGFPH |
|---|---|
| InChI | InChI=1S/C16H20O/c17-16(9-7-12-4-2-1-3-5-12)15-11-13-6-8-14(15)10-13/h1-5,13-15H,6-11H2/t13-,14+,15+/m1/s1 |
| InChIKey | WDNMZSDYDDYCAB-ILXRZTDVSA-N |
| Mol Weight | 228.33 g/mol |
| Molecular Formula | C16H20O |
| Exact Mass | 228.151415 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9jphSEmLHAE |
|---|---|
| Name | 1-{exo-Bicyclo[2.2.1]heptan-2-yl}-3-phenylpropan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.151415263 u |
| Formula | C16H20O |
| InChI | InChI=1S/C16H20O/c17-16(9-7-12-4-2-1-3-5-12)15-11-13-6-8-14(15)10-13/h1-5,13-15H,6-11H2/t13-,14+,15+/m1/s1 |
| InChIKey | WDNMZSDYDDYCAB-ILXRZTDVSA-N |
| Molecular Weight | 228.335 g/mol |
| SMILES | [C@]1(C[C@]2(C[C@@]1(CC2)[H])[H])(C(CCC=1C=CC=CC1)=O)[H] |