| SpectraBase Compound ID | IInSAS6oPLX |
|---|---|
| InChI | InChI=1S/C22H22O7/c1-12(23)29-18-6-4-13(7-19(18)24-2)21-15-9-26-22(16(15)10-25-21)14-3-5-17-20(8-14)28-11-27-17/h3-8,15-16,21-22H,9-11H2,1-2H3/t15?,16?,21?,22-/m0/s1 |
| InChIKey | DHVSZJJYRPBLIQ-CWFBCUTFSA-N |
| Mol Weight | 398.41 g/mol |
| Molecular Formula | C22H22O7 |
| Exact Mass | 398.136553 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Crr4EaWKDza |
|---|---|
| Name | (+)-XANTHOXYLOL MONOACETATE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C22H22O7 |
| InChI | InChI=1S/C22H22O7/c1-12(23)29-18-6-4-13(7-19(18)24-2)21-15-9-26-22(16(15)10-25-21)14-3-5-17-20(8-14)28-11-27-17/h3-8,15-16,21-22H,9-11H2,1-2H3/t15?,16?,21?,22-/m0/s1 |
| InChIKey | DHVSZJJYRPBLIQ-CWFBCUTFSA-N |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |