| SpectraBase Compound ID | 7RpY4ew19qr |
|---|---|
| InChI | InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12+,14+,15-,16+,18+,19-/m1/s1 |
| InChIKey | HUVIXLWRQSMCLN-FSUGKLMFSA-N |
| Mol Weight | 434.44 g/mol |
| Molecular Formula | C19H30O11 |
| Exact Mass | 434.178812 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9qr6eDszYbh |
|---|---|
| Name | SECOLOGANIN_DIMETHYLACETAL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C19H30O11 |
| InChI | InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12+,14+,15-,16+,18+,19-/m1/s1 |
| InChIKey | HUVIXLWRQSMCLN-FSUGKLMFSA-N |
| Literature Reference Author | K.MACHIDA,J.ASANO,M.KIKUCHI |
| Literature Reference Citation | PHYTOCHEM.,39,111(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00853-L |
| Molecular Weight | 434.441 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ8323 |