| SpectraBase Compound ID | ArZj2t29MSP |
|---|---|
| InChI | InChI=1S/C18H18O2/c1-14-6-2-4-8-16(14)9-5-3-7-15-10-11-17-18(12-15)20-13-19-17/h2,4-6,8-12H,3,7,13H2,1H3/b9-5+ |
| InChIKey | GBZOZLDWZZZRAZ-WEVVVXLNSA-N |
| Mol Weight | 266.34 g/mol |
| Molecular Formula | C18H18O2 |
| Exact Mass | 266.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FviByuXfNBW |
|---|---|
| Name | (E)-4-(3',4'-Methylenedioxyphenyl)-1-(2-methylphenyl)but-1-ene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.130679818 u |
| Formula | C18H18O2 |
| InChI | InChI=1S/C18H18O2/c1-14-6-2-4-8-16(14)9-5-3-7-15-10-11-17-18(12-15)20-13-19-17/h2,4-6,8-12H,3,7,13H2,1H3/b9-5+ |
| InChIKey | GBZOZLDWZZZRAZ-WEVVVXLNSA-N |
| Molecular Weight | 266.340 g/mol |
| SMILES | C1=CC(CC\C=C\C2=C(C=CC=C2)C)=CC2=C1OCO2 |