| SpectraBase Compound ID | 1hRox7ncecm |
|---|---|
| InChI | InChI=1S/C18H28O3/c19-13-9-7-5-3-1-2-4-6-8-10-16-11-12-17-18(14-16)21-15-20-17/h11-12,14,19H,1-10,13,15H2 |
| InChIKey | HKDRIJWKJIDWTB-UHFFFAOYSA-N |
| Mol Weight | 292.42 g/mol |
| Molecular Formula | C18H28O3 |
| Exact Mass | 292.203845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D8b4NJehoZ7 |
|---|---|
| Name | 11-(1,3-Benzodioxol-5-yl)-1-undecanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.203844759 u |
| Formula | C18H28O3 |
| InChI | InChI=1S/C18H28O3/c19-13-9-7-5-3-1-2-4-6-8-10-16-11-12-17-18(14-16)21-15-20-17/h11-12,14,19H,1-10,13,15H2 |
| InChIKey | HKDRIJWKJIDWTB-UHFFFAOYSA-N |
| Molecular Weight | 292.419 g/mol |
| SMILES | C12=C(OCO2)C=CC(=C1)CCCCCCCCCCCO |