| SpectraBase Compound ID | IAthowugJdh |
|---|---|
| InChI | InChI=1S/C20H32O6/c1-8-12(21)11-15(24)18(4)6-9-10(7-17(2,3)14(9)23)19(18,5)16(25)20(11,26)13(8)22/h8-13,15-16,21-22,24-26H,6-7H2,1-5H3/t8-,9-,10-,11-,12+,13-,15-,16-,18+,19-,20+/m1/s1 |
| InChIKey | MFGLOUGDECJCIQ-AFXZTQHDSA-N |
| Mol Weight | 368.5 g/mol |
| Molecular Formula | C20H32O6 |
| Exact Mass | 368.219889 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D7vXwPhuLks |
|---|---|
| Name | SEGETALOL |
| Compound Number | 1B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H32O6 |
| InChI | InChI=1S/C20H32O6/c1-8-12(21)11-15(24)18(4)6-9-10(7-17(2,3)14(9)23)19(18,5)16(25)20(11,26)13(8)22/h8-13,15-16,21-22,24-26H,6-7H2,1-5H3/t8-,9-,10-,11-,12+,13-,15-,16-,18+,19-,20+/m1/s1 |
| InChIKey | MFGLOUGDECJCIQ-AFXZTQHDSA-N |
| Literature Reference Author | M.J.U.FERREIRA,A.M.MADUREIRA,J.R.ASCENSO |
| Literature Reference Citation | PHYTOCHEM.,49,179(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)01011-X |
| Molecular Weight | 368.470 g/mol |
| Solvent | CDCl3:CD3OD=9:1 |
| Source File Reference | UWLU58 |