| SpectraBase Compound ID | 9ZMJxIuiBrH |
|---|---|
| InChI | InChI=1S/C22H34O5/c1-4-17(23)11-9-7-5-6-8-10-12-18-13-16-14-19(25-2)15-20(26-3)21(16)22(24)27-18/h14-15,17-18,23H,4-13H2,1-3H3/t17-,18-/m0/s1 |
| InChIKey | NNMRUQZUPWNXCM-ROUUACIJSA-N |
| Mol Weight | 378.5 g/mol |
| Molecular Formula | C22H34O5 |
| Exact Mass | 378.240624 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EZwP5lt09Zz |
|---|---|
| Name | (3R,9'S)-3-(9'-HYDROXYUNDECYL)-6,8-DIMETHOXY-3,4-DIHYDROISOCOUMARIN |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C22H34O5 |
| InChI | InChI=1S/C22H34O5/c1-4-17(23)11-9-7-5-6-8-10-12-18-13-16-14-19(25-2)15-20(26-3)21(16)22(24)27-18/h14-15,17-18,23H,4-13H2,1-3H3/t17-,18-/m0/s1 |
| InChIKey | NNMRUQZUPWNXCM-ROUUACIJSA-N |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |