| SpectraBase Compound ID | 9imCZ5ux6UN |
|---|---|
| InChI | InChI=1S/C28H36O14/c1-12(31)20-15(7-4-13-2-5-14(32)6-3-13)16(39-27-25(37)23(35)21(33)18(10-29)41-27)8-9-17(20)40-28-26(38)24(36)22(34)19(11-30)42-28/h2-3,5-6,8-9,18-19,21-30,32-38H,4,7,10-11H2,1H3/t18-,19+,21-,22+,23+,24-,25-,26+,27-,28+/m0/s1 |
| InChIKey | RRWOYFGPRBTVHR-DIZUDLDXSA-N |
| Mol Weight | 596.6 g/mol |
| Molecular Formula | C28H36O14 |
| Exact Mass | 596.210506 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LeZfk9TxfGY |
|---|---|
| Name | TYROLOBIBENZYL-E |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H36O14 |
| InChI | InChI=1S/C28H36O14/c1-12(31)20-15(7-4-13-2-5-14(32)6-3-13)16(39-27-25(37)23(35)21(33)18(10-29)41-27)8-9-17(20)40-28-26(38)24(36)22(34)19(11-30)42-28/h2-3,5-6,8-9,18-19,21-30,32-38H,4,7,10-11H2,1H3/t18-,19+,21-,22+,23+,24-,25-,26+,27-,28+/m0/s1 |
| InChIKey | RRWOYFGPRBTVHR-DIZUDLDXSA-N |
| Literature Reference Author | C.ZIDORN,E.P.ELLMERER,S.STURM,H.STUPPNER |
| Literature Reference Citation | PHYTOCHEM.,63,61(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(02)00714-8 |
| Molecular Weight | 596.585 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU29684 |