| SpectraBase Compound ID | GnJ9hruZ3gR |
|---|---|
| InChI | InChI=1S/C18H18/c1-3-8-15(9-4-1)14-17-12-7-13-18(17)16-10-5-2-6-11-16/h1-6,8-11H,7,12-14H2 |
| InChIKey | VXNRBSDMDDKRNG-UHFFFAOYSA-N |
| Mol Weight | 234.34 g/mol |
| Molecular Formula | C18H18 |
| Exact Mass | 234.140851 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IqA60pibTDP |
|---|---|
| Name | 1-(2-Benzylcyclopent-1-en-1-yl)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.140850580 u |
| Formula | C18H18 |
| InChI | InChI=1S/C18H18/c1-3-8-15(9-4-1)14-17-12-7-13-18(17)16-10-5-2-6-11-16/h1-6,8-11H,7,12-14H2 |
| InChIKey | VXNRBSDMDDKRNG-UHFFFAOYSA-N |
| Molecular Weight | 234.342 g/mol |
| SMILES | C1(=C(C2=CC=CC=C2)CCC1)CC=1C=CC=CC1 |