![2-Phenylbicyclo[2.2.2]octene](/api/spectrum/EIsI6AvQnyP/structure.png?h=300&w=458 "2-Phenylbicyclo[2.2.2]octene")
| SpectraBase Compound ID | 9QcZYnAMMlC |
|---|---|
| InChI | InChI=1S/C14H16/c1-2-4-12(5-3-1)14-10-11-6-8-13(14)9-7-11/h1-5,10-11,13H,6-9H2 |
| InChIKey | KRVNSCUASPWTTJ-UHFFFAOYSA-N |
| Mol Weight | 184.28 g/mol |
| Molecular Formula | C14H16 |
| Exact Mass | 184.125201 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EIsI6AvQnyP |
|---|---|
| Name | 2-Phenylbicyclo[2.2.2]octene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.125200515 u |
| Formula | C14H16 |
| InChI | InChI=1S/C14H16/c1-2-4-12(5-3-1)14-10-11-6-8-13(14)9-7-11/h1-5,10-11,13H,6-9H2 |
| InChIKey | KRVNSCUASPWTTJ-UHFFFAOYSA-N |
| Molecular Weight | 184.282 g/mol |
| SMILES | C1(=CC2CCC1CC2)C=1C=CC=CC1 |