![1-[7',7'-Dimethoxy-3'-methyl-3'-heptenyl]-2,6,6-trimethyl-1-cyclohexene](/api/spectrum/5rt3qXjYLNr/structure.png?h=300&w=458 "1-[7',7'-Dimethoxy-3'-methyl-3'-heptenyl]-2,6,6-trimethyl-1-cyclohexene")
| SpectraBase Compound ID | 78gBZ2fmQAG |
|---|---|
| InChI | InChI=1S/C19H34O2/c1-15(9-7-11-18(20-5)21-6)12-13-17-16(2)10-8-14-19(17,3)4/h9,18H,7-8,10-14H2,1-6H3/b15-9+ |
| InChIKey | OSEDSPGTOFVPAD-OQLLNIDSSA-N |
| Mol Weight | 294.5 g/mol |
| Molecular Formula | C19H34O2 |
| Exact Mass | 294.25588 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5rt3qXjYLNr |
|---|---|
| Name | 1-[7',7'-Dimethoxy-3'-methyl-3'-heptenyl]-2,6,6-trimethyl-1-cyclohexene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.255880333 u |
| Formula | C19H34O2 |
| InChI | InChI=1S/C19H34O2/c1-15(9-7-11-18(20-5)21-6)12-13-17-16(2)10-8-14-19(17,3)4/h9,18H,7-8,10-14H2,1-6H3/b15-9+ |
| InChIKey | OSEDSPGTOFVPAD-OQLLNIDSSA-N |
| SMILES | C1(=C(CCCC1(C)C)C)CC\C(=C\CCC(OC)OC)C |