![2-phenylbicyclo[2.2.2]octa-2,5-diene](/api/spectrum/3OQk988KCOY/structure.png?h=300&w=458 "2-phenylbicyclo[2.2.2]octa-2,5-diene")
| SpectraBase Compound ID | LCegPoO4sUX |
|---|---|
| InChI | InChI=1S/C14H14/c1-2-4-12(5-3-1)14-10-11-6-8-13(14)9-7-11/h1-6,8,10-11,13H,7,9H2 |
| InChIKey | RJIPZLBZTZIVPK-UHFFFAOYSA-N |
| Mol Weight | 182.27 g/mol |
| Molecular Formula | C14H14 |
| Exact Mass | 182.10955 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3OQk988KCOY |
|---|---|
| Name | 2-phenylbicyclo[2.2.2]octa-2,5-diene |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H14 |
| InChI | InChI=1S/C14H14/c1-2-4-12(5-3-1)14-10-11-6-8-13(14)9-7-11/h1-6,8,10-11,13H,7,9H2 |
| InChIKey | RJIPZLBZTZIVPK-UHFFFAOYSA-N |
| Molecular Weight | 182.266 g/mol |
| SMILES | C1(=CC2C=CC1CC2)c1ccccc1 |
| SPLASH | splash10-0udi-0900000000-1453054ddf3c2659e4e1 |
| Source of Spectrum | J-54-2556-0 |
| Wiley ID | 1179409 |