| SpectraBase Compound ID | 2RYrQ9Pd410 |
|---|---|
| InChI | InChI=1S/C21H26O9/c1-9(2)16(24)27-13-8-19(6,29-11(4)22)21(26)12-7-18(5,30-21)14(23)15-20(12,13)10(3)17(25)28-15/h12-15,23,26H,1,3,7-8H2,2,4-6H3/t12-,13+,14-,15-,18+,19-,20+,21-/m1/s1 |
| InChIKey | OOKBNCRQBMPQGY-ZVGOANGBSA-N |
| Mol Weight | 422.43 g/mol |
| Molecular Formula | C21H26O9 |
| Exact Mass | 422.157682 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CMhPOyMOp7J |
|---|---|
| Name | OOKBNCRQBMPQGY-ZVGOANGBSA-N |
| Compound Number | 4B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H26O9 |
| InChI | InChI=1S/C21H26O9/c1-9(2)16(24)27-13-8-19(6,29-11(4)22)21(26)12-7-18(5,30-21)14(23)15-20(12,13)10(3)17(25)28-15/h12-15,23,26H,1,3,7-8H2,2,4-6H3/t12-,13+,14-,15-,18+,19-,20+,21-/m1/s1 |
| InChIKey | OOKBNCRQBMPQGY-ZVGOANGBSA-N |
| Literature Reference Author | L.RODRIGUEZ-HAHN |
| Literature Reference Citation | J.ORG.CHEM.,53,2965(1988) |
| Literature Reference DOI | 10.1021/jo00248a012 |
| Molecular Weight | 422.432 g/mol |
| Solvent | CDCl3:DMSO-D6 |
| Source File Reference | UNIW20973 |