| SpectraBase Compound ID | 9TpOo4sgYIn |
|---|---|
| InChI | InChI=1S/C18H24O2/c1-6-14(2)18(20-5)15(3)17(19-4)13-12-16-10-8-7-9-11-16/h1,7-15,17-18H,2-5H3/b13-12+ |
| InChIKey | AXOJNQPVRUDDJH-OUKQBFOZSA-N |
| Mol Weight | 272.39 g/mol |
| Molecular Formula | C18H24O2 |
| Exact Mass | 272.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1uAXZqrN4e1 |
|---|---|
| Name | 3,5-Dimethyl-4,6-dimethoxy-8-phenyloct-7-en-1-yne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.177630011 u |
| Formula | C18H24O2 |
| InChI | InChI=1S/C18H24O2/c1-6-14(2)18(20-5)15(3)17(19-4)13-12-16-10-8-7-9-11-16/h1,7-15,17-18H,2-5H3/b13-12+ |
| InChIKey | AXOJNQPVRUDDJH-OUKQBFOZSA-N |
| SMILES | C#CC(C(C(C(\C=C\C=1C=CC=CC1)OC)C)OC)C |