| SpectraBase Compound ID | 9liWjWTdNtX |
|---|---|
| InChI | InChI=1S/C16H22O11/c17-3-8-10(19)11(20)12(21)15(26-8)27-14-9-6(1-2-16(9,24)5-18)7(4-25-14)13(22)23/h1-2,4,6,8-12,14-15,17-21,24H,3,5H2,(H,22,23)/t6?,8-,9?,10-,11+,12-,14?,15+,16?/m0/s1 |
| InChIKey | HPWWQPXTUDMRBI-KCNBDTJTSA-N |
| Mol Weight | 390.34 g/mol |
| Molecular Formula | C16H22O11 |
| Exact Mass | 390.116212 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HFPfjb2ASaT |
|---|---|
| Name | Monotropein |
| CAS Registry Number | 5945-50-6 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C16H22O11 |
| InChI | InChI=1S/C16H22O11/c17-3-8-10(19)11(20)12(21)15(26-8)27-14-9-6(1-2-16(9,24)5-18)7(4-25-14)13(22)23/h1-2,4,6,8-12,14-15,17-21,24H,3,5H2,(H,22,23)/t6?,8-,9?,10-,11+,12-,14?,15+,16?/m0/s1 |
| InChIKey | HPWWQPXTUDMRBI-KCNBDTJTSA-N |
| Literature Reference | E. Davini, P. Esposito, Phytochem. 20, 1538 (1981). |
| NMR Standard | Dioxane |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O |