| SpectraBase Compound ID | ESU1SuiGLDF |
|---|---|
| InChI | InChI=1S/C16H20/c1-4-9-14(3)12-13-15(5-2)16-10-7-6-8-11-16/h4-11H,1,12-13H2,2-3H3/b14-9+,15-5- |
| InChIKey | SDMDBZJNBDXFHJ-AUFQKOBLSA-N |
| Mol Weight | 212.34 g/mol |
| Molecular Formula | C16H20 |
| Exact Mass | 212.156501 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FJCLbyQ2VAH |
|---|---|
| Name | (2E,7Z)-4-Methyl-7-phenylnona-1,3,7-triene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.156500644 u |
| Formula | C16H20 |
| InChI | InChI=1S/C16H20/c1-4-9-14(3)12-13-15(5-2)16-10-7-6-8-11-16/h4-11H,1,12-13H2,2-3H3/b14-9+,15-5- |
| InChIKey | SDMDBZJNBDXFHJ-AUFQKOBLSA-N |
| Molecular Weight | 212.336 g/mol |
| SMILES | C=C\C=C\(CC\C(=C\C)C=1C=CC=CC1)C |