| SpectraBase Compound ID | BGaQAggt9dl |
|---|---|
| InChI | InChI=1S/C18H22O5/c1-20-14-7-12(8-15(11-14)21-2)9-16(19)13-5-6-17(22-3)18(10-13)23-4/h5-8,10-11,16,19H,9H2,1-4H3 |
| InChIKey | NXYSHFHZAWNZHT-UHFFFAOYSA-N |
| Mol Weight | 318.37 g/mol |
| Molecular Formula | C18H22O5 |
| Exact Mass | 318.146724 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GXkOO6kd2tB |
|---|---|
| Name | 1-(3,4-Dimethoxyphenyl)-2-(3,5-dimethoxyphenyl)ethanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.146723803 u |
| Formula | C18H22O5 |
| InChI | InChI=1S/C18H22O5/c1-20-14-7-12(8-15(11-14)21-2)9-16(19)13-5-6-17(22-3)18(10-13)23-4/h5-8,10-11,16,19H,9H2,1-4H3 |
| InChIKey | NXYSHFHZAWNZHT-UHFFFAOYSA-N |
| Molecular Weight | 318.369 g/mol |
| SMILES | C=1(C=C(OC)C(=CC1)OC)C(CC=1C=C(OC)C=C(C1)OC)O |