![3-[(E)-4,4-Dimethylpent-2-enyl]-4'-methylbiphenyl](/api/spectrum/H5ZCEOtCfWs/structure.png?h=300&w=458 "3-[(E)-4,4-Dimethylpent-2-enyl]-4'-methylbiphenyl")
| SpectraBase Compound ID | L0lKbTw6XF |
|---|---|
| InChI | InChI=1S/C20H24/c1-16-10-12-18(13-11-16)19-9-5-7-17(15-19)8-6-14-20(2,3)4/h5-7,9-15H,8H2,1-4H3/b14-6+ |
| InChIKey | ISGVHDVOTSKICV-MKMNVTDBSA-N |
| Mol Weight | 264.41 g/mol |
| Molecular Formula | C20H24 |
| Exact Mass | 264.187801 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H5ZCEOtCfWs |
|---|---|
| Name | 3-[(E)-4,4-Dimethylpent-2-enyl]-4'-methylbiphenyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.187800773 u |
| Formula | C20H24 |
| InChI | InChI=1S/C20H24/c1-16-10-12-18(13-11-16)19-9-5-7-17(15-19)8-6-14-20(2,3)4/h5-7,9-15H,8H2,1-4H3/b14-6+ |
| InChIKey | ISGVHDVOTSKICV-MKMNVTDBSA-N |
| Molecular Weight | 264.412 g/mol |
| SMILES | C=1(C=C(C=CC1)C\C=C\C(C)(C)C)C=1C=CC(=CC1)C |